Skipping 3,024 KB..
Full Logintegrate_kbpp_e_band_local.F:183:0: note: loop vectorized
integrate_kbpp_e_band_local.F:183:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local.F:178:0: note: loop vectorized
integrate_kbpp_e_band_local.F:178:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local.F:170:0: note: loop vectorized
integrate_kbpp_e_band_local.F:170:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local.F:118:0: note: loop vectorized
integrate_kbpp_e_band_local.F:118:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local.F:112:0: note: loop vectorized
integrate_kbpp_e_band_local.F:112:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local.F:94:0: note: loop vectorized
integrate_kbpp_e_band_local.F:94:0: note: loop versioned for vectorization because of possible aliasing
integrate_kbpp_e_band_local.F:94:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local.F:66:0: note: loop vectorized
integrate_kbpp_e_band_local.F:66:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_local.F
integrate_kbpp_e_band_local_new.F:367:0: note: loop vectorized
integrate_kbpp_e_band_local_new.F:367:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local_new.F:120:0: note: loop vectorized
integrate_kbpp_e_band_local_new.F:120:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local_new.F:114:0: note: loop vectorized
integrate_kbpp_e_band_local_new.F:114:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local_new.F:96:0: note: loop vectorized
integrate_kbpp_e_band_local_new.F:96:0: note: loop versioned for vectorization because of possible aliasing
integrate_kbpp_e_band_local_new.F:96:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_local_new.F:74:0: note: loop vectorized
integrate_kbpp_e_band_local_new.F:74:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_local_new.F
integrate_kbpp_e_band_ray.F:201:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:201:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:186:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:186:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:179:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:179:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:166:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:166:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:161:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:161:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:154:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:154:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:144:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:144:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:133:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:133:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:120:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:120:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:106:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:106:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_ray.F:58:0: note: loop vectorized
integrate_kbpp_e_band_ray.F:58:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_ray.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG kbpp_e_band_stress.F
integrate_kbpp_e_band_stress_local.F:117:0: note: loop vectorized
integrate_kbpp_e_band_stress_local.F:117:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_local.F:106:0: note: loop vectorized
integrate_kbpp_e_band_stress_local.F:106:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_local.F:76:0: note: loop vectorized
integrate_kbpp_e_band_stress_local.F:76:0: note: loop versioned for vectorization because of possible aliasing
integrate_kbpp_e_band_stress_local.F:76:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_local_new.F:97:0: note: loop vectorized
integrate_kbpp_e_band_stress_local_new.F:97:0: note: loop versioned for vectorization because of possible aliasing
integrate_kbpp_e_band_stress_local_new.F:97:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_local_new.F:73:0: note: loop vectorized
integrate_kbpp_e_band_stress_local_new.F:73:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_stress_local.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_stress_local_new.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_stress_ray.F
integrate_kbpp_e_band_stress_ray.F:199:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:199:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:192:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:192:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:182:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:182:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:170:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:170:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:164:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:164:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:149:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:149:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:142:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:142:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:126:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:126:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:118:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:118:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_ray.F:65:0: note: loop vectorized
integrate_kbpp_e_band_stress_ray.F:65:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:392:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:392:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:340:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:340:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:334:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:334:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:257:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:257:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:250:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:250:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:147:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:147:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:139:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:139:0: note: loop peeled for vectorization to enhance alignment
integrate_kbpp_e_band_stress_nonlocal.F:65:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal.F:65:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_stress_nonlocal.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG integrate_kbpp_e_band_stress_nonlocal_new.F
integrate_kbpp_e_band_stress_nonlocal_new.F:71:0: note: loop vectorized
integrate_kbpp_e_band_stress_nonlocal_new.F:71:0: note: loop peeled for vectorization to enhance alignment
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/kbpp'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/kbpp'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a cpsp_formatter_auto.o borbs_formatter.o kbpp_band.o kbpp_band_orb.o setup_kbpp_band.o integrate_kbpp_band_local.o integrate_kbpp_band_nonlocal.o integrate_kbpp_band_orb.o kbpp_band_ray.o integrate_kbpp_band_ray.o integrate_kbpp_band_local_new.o integrate_kbpp_band_nonlocal_new.o cpsp_stress_formatter_auto.o kbpp_band_stress.o integrate_kbpp_band_stress_local.o integrate_kbpp_band_stress_nonlocal.o integrate_kbpp_band_stress_ray.o integrate_kbpp_band_stress_local_new.o integrate_kbpp_band_stress_nonlocal_new.o HGH_band_local.o HGH_band_nonlocal.o Tesseral_band.o Spherical_band.o hghpp_band.o rkbpp_band.o kbpp_e_band.o integrate_kbpp_e_band_nonlocal.o integrate_kbpp_e_band_nonlocal_new.o integrate_kbpp_e_band_local.o integrate_kbpp_e_band_local_new.o integrate_kbpp_e_band_ray.o kbpp_e_band_stress.o integrate_kbpp_e_band_stress_local.o integrate_kbpp_e_band_stress_local_new.o integrate_kbpp_e_band_stress_ray.o integrate_kbpp_e_band_stress_nonlocal.o integrate_kbpp_e_band_stress_nonlocal_new.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/kbpp'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/kbpp'
Making all in makepsi
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/makepsi'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/makepsi'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_wvfnc_new.F
c_wvfnc_new.F:345:0: note: loop vectorized
c_wvfnc_new.F:345:0: note: loop vectorized
c_wvfnc_new.F: In function 'sub_c_wvfnc_new':
c_wvfnc_new.F:133:0: warning: 'IMAGPART_EXPR <cc>' may be used uninitialized in this function [-Wmaybe-uninitialized]
double complex cc,cx,sx,zx,zc
^
c_wvfnc_new.F:133:0: warning: 'REALPART_EXPR <cc>' may be used uninitialized in this function [-Wmaybe-uninitialized]
c_wvfnc_new.F:345:0: note: loop vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_wvfnc_expander.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_v_wvfnc_new.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG pspw_reformat_c_wvfnc.F
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/makepsi'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/makepsi'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a c_wvfnc_new.o c_wvfnc_expander.o c_v_wvfnc_new.o pspw_reformat_c_wvfnc.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/makepsi'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/makepsi'
Making all in lib
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib'
Making all in cpsp
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/cpsp'
cpsp.F:339:0: note: loop vectorized
cpsp.F:339:0: note: loop peeled for vectorization to enhance alignment
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/cpsp'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsp.F
cpsp.F:339:0: note: loop vectorized
cpsp.F:339:0: note: loop peeled for vectorization to enhance alignment
cpsp.F:491:0: note: loop vectorized
cpsp.F:592:0: note: loop vectorized
cpsp.F: In function 'cpsp_v_nonlocal':
cpsp.F:642:0: warning: 'occ1_shift' may be used uninitialized in this function [-Wmaybe-uninitialized]
integer occ_tag,occ_shift,occ1_shift
^
cpsp.F:638:0: warning: 'g[2]' may be used uninitialized in this function [-Wmaybe-uninitialized]
integer nfft3d,G(3),npack1,npack
^
cpsp.F:638:0: warning: 'g[1]' may be used uninitialized in this function [-Wmaybe-uninitialized]
cpsp.F:638:0: warning: 'g[0]' may be used uninitialized in this function [-Wmaybe-uninitialized]
cpsp.F: In function 'cpsp_f_vnonlocal':
cpsp.F:1228:0: warning: 'occ1_shift' may be used uninitialized in this function [-Wmaybe-uninitialized]
integer occ1_tag,occ1_shift,occ_shift
^
cpsp.F:339:0: note: loop vectorized
cpsp.F:339:0: note: loop peeled for vectorization to enhance alignment
cpsp_relativistic.F:585:0: note: loop vectorized
cpsp_relativistic.F: In function 'cpsp_v_spin_orbit':
cpsp_relativistic.F:383:0: warning: 'g[2]' may be used uninitialized in this function [-Wmaybe-uninitialized]
integer nfft3d,G(3),npack1,npack
^
cpsp_relativistic.F:383:0: warning: 'g[1]' may be used uninitialized in this function [-Wmaybe-uninitialized]
cpsp_relativistic.F:383:0: warning: 'g[0]' may be used uninitialized in this function [-Wmaybe-uninitialized]
cpsp_relativistic.F:1143:0: note: loop vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsp_relativistic.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsp_projector.F
cpsp_projector.F:46:0: note: loop vectorized
cpsp_projector.F:46:0: note: loop peeled for vectorization to enhance alignment
cpsp_stress.F:216:0: note: loop vectorized
cpsp_stress.F: In function 'cpsp_v_nonlocal_euv_2':
cpsp_stress.F:249:0: warning: 'occ1_shift' may be used uninitialized in this function [-Wmaybe-uninitialized]
integer nproj,l_prj,psi1_shift,occ1_tag,occ1_shift,occ_shift
^
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsp_stress.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_semicore.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_semicore_force.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/cpsp'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/cpsp'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a cpsp.o cpsp_relativistic.o cpsp_projector.o cpsp_stress.o c_semicore.o c_semicore_force.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/cpsp'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/cpsp'
Making all in ke
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/ke'
cke.F:53:0: note: loop vectorized
cke.F:53:0: note: loop versioned for vectorization because of possible aliasing
cke.F:53:0: note: loop peeled for vectorization to enhance alignment
cke.F:390:0: note: loop vectorized
cke.F:390:0: note: loop versioned for vectorization because of possible aliasing
cke.F:390:0: note: loop peeled for vectorization to enhance alignment
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/ke'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cke.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/ke'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/ke'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a cke.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/ke'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/ke'
Making all in coulomb
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/coulomb'
c_coulomb.F:59:0: note: loop vectorized
c_coulomb.F:59:0: note: loop versioned for vectorization because of possible aliasing
c_coulomb.F:59:0: note: loop peeled for vectorization to enhance alignment
c_coulomb.F:59:0: note: loop vectorized
c_coulomb.F:59:0: note: loop versioned for vectorization because of possible aliasing
c_coulomb.F:59:0: note: loop peeled for vectorization to enhance alignment
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/coulomb'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_coulomb.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_coulomb_screened.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/coulomb'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/coulomb'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a c_coulomb.o c_coulomb_screened.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/coulomb'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/coulomb'
Making all in electron
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/electron'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/electron'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_electron.F
c_electron.F:320.33:
> dbl_mb(psi1_shift),
1
Warning: Type mismatch in argument 'psi1' at (1); passed REAL(8) to COMPLEX(8)
c_electron.F:847:0: note: loop vectorized
c_electron.F:847:0: note: loop peeled for vectorization to enhance alignment
c_electron.F:847:0: note: loop vectorized
c_electron.F:847:0: note: loop versioned for vectorization because of possible aliasing
c_electron.F:847:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_H.F
cpsi_H.F: In function 'cpsi_h':
cpsi_H.F:148:0: warning: 'hpsir_shift' may be used uninitialized in this function [-Wmaybe-uninitialized]
if (dohfx) Hpsir_shift = Hpsir_shift + nshift1
^
cpsi_H.F:33:0: note: 'hpsir_shift' was declared here
integer psi_shift,Hpsi_shift,Hpsir_shift,nshift1,nshift2
^
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/electron'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/electron'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a c_electron.o cpsi_H.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/electron'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/electron'
Making all in psi
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/psi'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/psi'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi.F
cpsi.F:1019:0: note: loop vectorized
cpsi.F:1019:0: note: loop peeled for vectorization to enhance alignment
cpsi.F:1760:0: note: loop vectorized
cpsi.F:1760:0: note: loop versioned for vectorization because of possible aliasing
cpsi.F:1760:0: note: loop peeled for vectorization to enhance alignment
cpsi.F:2914:0: note: loop vectorized
cpsi.F:2914:0: note: loop versioned for vectorization because of possible aliasing
cpsi.F:2914:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_geodesic.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_lmbda.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_KS.F
cpsi_KS.F:1279.19:
> dbl_mb(psi1_shift+(i-1)*nshift))
1
Warning: Type mismatch in argument 'horb' at (1); passed REAL(8) to COMPLEX(8)
cpsi_KS.F:281.45:
call cpsi_project_out_f_orb1(nb,i,dbl_mb(psi1_shift))
1
Warning: Type mismatch in argument 'horb' at (1); passed REAL(8) to COMPLEX(8)
cpsi_KS.F:1385.19:
> dbl_mb(psi_ptr))
1
Warning: Type mismatch in argument 'horb' at (1); passed REAL(8) to COMPLEX(8)
cpsi_KS.F:370.45:
call cpsi_project_out_f_orb1(nb,i,dbl_mb(psi1_shift))
1
Warning: Type mismatch in argument 'horb' at (1); passed REAL(8) to COMPLEX(8)
cpsi_KS.F:2333.46:
call cpsi_project_out_virtual1(nb,ii,dbl_mb(epsi_ptr))
1
Warning: Type mismatch in argument 'horb' at (1); passed REAL(8) to COMPLEX(8)
cpsi_KS.F:1557:0: note: basic block vectorized
BGrsm.F:254:0: note: loop vectorized
BGrsm.F:254:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:180:0: note: loop vectorized
BGrsm.F:180:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:161:0: note: loop vectorized
BGrsm.F:161:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:180:0: note: loop vectorized
BGrsm.F:180:0: note: loop versioned for vectorization because of possible aliasing
BGrsm.F:180:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:236:0: note: loop vectorized
BGrsm.F:236:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:254:0: note: loop vectorized
BGrsm.F:254:0: note: loop versioned for vectorization because of possible aliasing
BGrsm.F:254:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:312:0: note: loop vectorized
BGrsm.F:312:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:418:0: note: loop vectorized
BGrsm.F:418:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:479:0: note: loop vectorized
BGrsm.F:479:0: note: loop peeled for vectorization to enhance alignment
BGrsm.F:609:0: note: loop vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG BGrsm.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_spin2.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG c_check.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_read.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_write.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG cpsi_new.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG v_cpsi_new.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG v_cpsi_read.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG v_cpsi_write.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/psi'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/psi'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a cpsi.o c_geodesic.o cpsi_lmbda.o cpsi_KS.o BGrsm.o cpsi_spin2.o c_check.o cpsi_read.o cpsi_write.o cpsi_new.o v_cpsi_new.o v_cpsi_read.o v_cpsi_write.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/psi'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/psi'
Making all in hfx
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/hfx'
band_hfx.F:356.24:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag, nb1)),
1
Warning: Type mismatch in argument 'psi_r' at (1); passed REAL(8) to COMPLEX(8)
band_hfx.F:370.26:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag, nb1)),
1
Warning: Type mismatch in argument 'psi1_r' at (1); passed REAL(8) to COMPLEX(8)
band_hfx.F:421.26:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag,nb1)),
1
Warning: Type mismatch in argument 'psi1_r' at (1); passed REAL(8) to COMPLEX(8)
band_hfx.F:467.26:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag,nb1)),
1
Warning: Type mismatch in argument 'psi1_r' at (1); passed REAL(8) to COMPLEX(8)
band_hfx.F:497.24:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag, nb1)),
1
Warning: Type mismatch in argument 'psi_r' at (1); passed REAL(8) to COMPLEX(8)
band_hfx.F:512.26:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag, nb1)),
1
Warning: Type mismatch in argument 'psi1_r' at (1); passed REAL(8) to COMPLEX(8)
band_hfx.F:598.21:
> dbl_mb(cpsi_data_get_chnk(psi_r_tag,nbq2)),
1
Warning: Type mismatch in argument 'psi1_r' at (1); passed REAL(8) to COMPLEX(8)
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/hfx'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_hfx.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/hfx'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/hfx'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a band_hfx.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/hfx'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/hfx'
Making all in Grsm_list
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/Grsm_list'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/Grsm_list'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_Grsm_list.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_lmbfgs.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/Grsm_list'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/Grsm_list'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a band_Grsm_list.o band_lmbfgs.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/Grsm_list'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/Grsm_list'
Making all in borbs
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/borbs'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/borbs'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG borbs.F
borbs.F:611.24:
> dbl_mb(tmp(1)),dbl_mb(tmp2(1)),
1
Warning: Type mismatch in argument 'tmp' at (1); passed REAL(8) to COMPLEX(8)
borbs.F:662:0: note: loop vectorized
borbs.F:662:0: note: loop versioned for vectorization because of possible aliasing
borbs.F:662:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG borb_projector.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/borbs'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/borbs'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a borbs.o borb_projector.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/borbs'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib/borbs'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/lib'
Making all in dplot
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/dplot'
band_dplot_input.F:430:0: note: basic block vectorized
band_dplot_input.F:423:0: note: basic block vectorized
band_dplot_input.F:423:0: note: basic block vectorized
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/dplot'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_dplot_input.F
band_dplot.F:1672:0: note: loop vectorized
band_dplot.F:1304:0: note: loop vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_dplot.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_dplot_iteration.F
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/dplot'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/dplot'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a band_dplot_input.o band_dplot.o band_dplot_iteration.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/dplot'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/dplot'
Making all in analysis
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/analysis'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/analysis'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG band_analysis.F
band_analysis.F:627:0: note: loop vectorized
band_analysis.F:627:0: note: loop peeled for vectorization to enhance alignment
band_analysis.F:524:0: note: loop vectorized
band_analysis.F:524:0: note: loop versioned for vectorization because of possible aliasing
band_analysis.F:524:0: note: loop peeled for vectorization to enhance alignment
band_analysis.F:482:0: note: loop vectorized
band_analysis.F:482:0: note: loop peeled for vectorization to enhance alignment
band_analysis.F:475:0: note: loop vectorized
band_analysis.F:475:0: note: loop peeled for vectorization to enhance alignment
band_analysis.F: In function 'band_analysis':
band_analysis.F:335:0: warning: 'sum_shift' may be used uninitialized in this function [-Wmaybe-uninitialized]
WRITE(luout,1510) N,SPN(SPIN),dbl_mb(sum_shift+N-1),
^
band_analysis.F:52:0: note: 'sum_shift' was declared here
integer A_shift,sum_shift,psi_shift,eig_shift
^
orb_pop_borb.F:197:0: note: loop vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG orb_pop_borb.F
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/analysis'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/analysis'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a band_analysis.o orb_pop_borb.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/analysis'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band/analysis'
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a band_input.o task_band.o band_energy.o band_noit_energy.o band_gradient.o band_stress.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libband.a
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band'
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/band'
Making all in ofpw
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw'
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ofpw_energy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG task_ofpw.F
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw'
Making all in minimizer
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/minimizer'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/minimizer'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I../../nwpwlib/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ofpw_minimizer.F
ofpw_minimizer.F: In function 'ofpw_minimizer':
ofpw_minimizer.F:508:0: warning: 'nion' may be used uninitialized in this function [-Wmaybe-uninitialized]
> 3*nion,dbl_mb(fion(1)))
^
ofpw_minimizer.F:63:0: note: 'nion' was declared here
integer i,k,ia,nion,minimizer,mapping,mapping1d
^
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I../../nwpwlib/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ofpw_cgsd_energy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I../../nwpwlib/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ofpw_cgminimize.F
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/minimizer'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/minimizer'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a ofpw_minimizer.o ofpw_cgsd_energy.o ofpw_cgminimize.o
ar: creating /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/minimizer'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/minimizer'
Making all in cpsd
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/cpsd'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/cpsd'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ofpwsd.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG inner_loop_ofpw.F
inner_loop_ofpw.F:574:0: note: loop vectorized
inner_loop_ofpw.F:224:0: note: loop vectorized
inner_loop_ofpw.F:224:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec chi_lmbda.f
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/cpsd'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/cpsd'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a ofpwsd.o inner_loop_ofpw.o chi_lmbda.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/cpsd'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/cpsd'
Making all in lib
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib'
Making all in chi
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/chi'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/chi'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG chi_read.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG chi_write.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG chi_new.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG chi_expander.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/chi'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/chi'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a chi_read.o chi_write.o chi_new.o chi_expander.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/chi'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/chi'
Making all in electron
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/electron'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/electron'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG chi_H.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG chi_Hv4.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/electron'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/electron'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a chi_H.o chi_Hv4.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/electron'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/electron'
Making all in ke
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/ke'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -g -fno-aggressive-loop-optimizations -g -O -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG v_thomasfermi.F
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/ke'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a v_thomasfermi.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/ke'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/ke'
Making all in WGC
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/WGC'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/WGC'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG wgc.F
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/WGC'
make[5]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/WGC'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a wgc.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[5]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/WGC'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib/WGC'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib'
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw/lib'
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a ofpw_energy.o task_ofpw.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libofpw.a
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw'
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw/ofpw'
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libnwpw.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libnwpw.a nwpw_input.o nwpw_default.o nwpw_vectors_input.o
ar: creating /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libnwpw.a
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libnwpw.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libnwpw.a
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw'
make[1]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/nwpw'
Making libraries in fft
make[1]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft'
Making all in pfft1.0
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0'
Making all in fftpack
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/fftpack'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/fftpack'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dcfftb.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dcfftf.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dcffti.F
dcfti1.F: In function 'dcfti1':
dcfti1.F:16:0: warning: 'ntry' may be used uninitialized in this function [-Wmaybe-uninitialized]
if (j.gt.4) ntry = ntry + 2
^
dpssb.F:122:0: note: loop vectorized
dpssb.F:80:0: note: loop vectorized
dpssb.F:80:0: note: loop versioned for vectorization because of possible aliasing
dpssb.F:73:0: note: loop vectorized
dpssb.F:73:0: note: loop versioned for vectorization because of possible aliasing
dpssb.F:73:0: note: loop peeled for vectorization to enhance alignment
dpssb.F:65:0: note: loop vectorized
dpssb.F:65:0: note: loop versioned for vectorization because of possible aliasing
dpssb.F:65:0: note: loop peeled for vectorization to enhance alignment
dpssb.F:53:0: note: loop vectorized
dpssb.F:53:0: note: loop versioned for vectorization because of possible aliasing
dpssb.F:53:0: note: loop peeled for vectorization to enhance alignment
dpssb.F:18:0: note: loop vectorized
dpssb.F:18:0: note: loop versioned for vectorization because of possible aliasing
dpssb.F:18:0: note: loop peeled for vectorization to enhance alignment
dpssb.F:98:0: note: basic block vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dcftb1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dcftf1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dcfti1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssb.F
dpssb2.F:17:0: note: loop vectorized
dpssb2.F:17:0: note: loop versioned for vectorization because of possible aliasing
dpssb3.F:30:0: note: loop vectorized
dpssb3.F:30:0: note: loop versioned for vectorization because of possible aliasing
dpssb4.F:31:0: note: loop vectorized
dpssb4.F:31:0: note: loop versioned for vectorization because of possible aliasing
dpssb5.F:51:0: note: loop vectorized
dpssb5.F:51:0: note: loop versioned for vectorization because of possible aliasing
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssb2.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssb3.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssb4.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssb5.F
dpssf.F:122:0: note: loop vectorized
dpssf.F:80:0: note: loop vectorized
dpssf.F:80:0: note: loop versioned for vectorization because of possible aliasing
dpssf.F:73:0: note: loop vectorized
dpssf.F:73:0: note: loop versioned for vectorization because of possible aliasing
dpssf.F:73:0: note: loop peeled for vectorization to enhance alignment
dpssf.F:65:0: note: loop vectorized
dpssf.F:65:0: note: loop versioned for vectorization because of possible aliasing
dpssf.F:65:0: note: loop peeled for vectorization to enhance alignment
dpssf.F:53:0: note: loop vectorized
dpssf.F:53:0: note: loop versioned for vectorization because of possible aliasing
dpssf.F:53:0: note: loop peeled for vectorization to enhance alignment
dpssf.F:18:0: note: loop vectorized
dpssf.F:18:0: note: loop versioned for vectorization because of possible aliasing
dpssf.F:18:0: note: loop peeled for vectorization to enhance alignment
dpssf.F:98:0: note: basic block vectorized
dpssf2.F:17:0: note: loop vectorized
dpssf2.F:17:0: note: loop versioned for vectorization because of possible aliasing
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssf.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssf2.F
dpssf3.F:28:0: note: loop vectorized
dpssf3.F:28:0: note: loop versioned for vectorization because of possible aliasing
dpssf4.F:31:0: note: loop vectorized
dpssf4.F:31:0: note: loop versioned for vectorization because of possible aliasing
dpssf5.F:46:0: note: loop vectorized
dpssf5.F:46:0: note: loop versioned for vectorization because of possible aliasing
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssf3.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssf4.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dpssf5.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM drfftb.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM drfftf.F
drftb1.F:97:0: note: loop vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM drffti.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM drftb1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM drftf1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM drfti1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradb2.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradb3.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradb4.F
dradbg.F:210:0: note: loop vectorized
dradbg.F:195:0: note: loop vectorized
dradbg.F:195:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:182:0: note: loop vectorized
dradbg.F:182:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:148:0: note: loop vectorized
dradbg.F:148:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:148:0: note: loop peeled for vectorization to enhance alignment
dradbg.F:134:0: note: loop vectorized
dradbg.F:134:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:131:0: note: loop vectorized
dradbg.F:131:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:131:0: note: loop peeled for vectorization to enhance alignment
dradbg.F:119:0: note: loop vectorized
dradbg.F:119:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:119:0: note: loop peeled for vectorization to enhance alignment
dradbg.F:106:0: note: loop vectorized
dradbg.F:106:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:106:0: note: loop peeled for vectorization to enhance alignment
dradbg.F:51:0: note: loop vectorized
dradbg.F:51:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:32:0: note: loop vectorized
dradbg.F:32:0: note: loop versioned for vectorization because of possible aliasing
dradbg.F:33:0: note: basic block vectorized
dradbg.F:52:0: note: basic block vectorized
dradbg.F:135:0: note: basic block vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradb5.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradbg.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradf2.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradf3.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradf4.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradf5.F
dradfg.F:407:0: note: loop vectorized
dradfg.F:407:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:373:0: note: loop vectorized
dradfg.F:373:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:336:0: note: loop vectorized
dradfg.F:336:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:319:0: note: loop vectorized
dradfg.F:319:0: note: loop peeled for vectorization to enhance alignment
dradfg.F:305:0: note: loop vectorized
dradfg.F:305:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:292:0: note: loop vectorized
dradfg.F:292:0: note: loop peeled for vectorization to enhance alignment
dradfg.F:279:0: note: loop vectorized
dradfg.F:279:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:279:0: note: loop peeled for vectorization to enhance alignment
dradfg.F:266:0: note: loop vectorized
dradfg.F:266:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:266:0: note: loop peeled for vectorization to enhance alignment
dradfg.F:240:0: note: loop vectorized
dradfg.F:210:0: note: loop vectorized
dradfg.F:210:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:197:0: note: loop vectorized
dradfg.F:197:0: note: loop versioned for vectorization because of possible aliasing
dradfg.F:61:0: note: loop vectorized
dradfg.F:306:0: note: basic block vectorized
dradfg.F:338:0: note: basic block vectorized
dradfg.F:374:0: note: basic block vectorized
dradfg.F:408:0: note: basic block vectorized
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM dradfg.F
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/fftpack'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/fftpack'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a dcfftb.o dcfftf.o dcffti.o dcftb1.o dcftf1.o dcfti1.o dpssb.o dpssb2.o dpssb3.o dpssb4.o dpssb5.o dpssf.o dpssf2.o dpssf3.o dpssf4.o dpssf5.o drfftb.o drfftf.o drffti.o drftb1.o drftf1.o drfti1.o dradb2.o dradb3.o dradb4.o dradb5.o dradbg.o dradf2.o dradf3.o dradf4.o dradf5.o dradfg.o
ar: creating /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/fftpack'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/fftpack'
Making all in pfft
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/pfft'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/pfft'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK blktrn.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK drain.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK fillup.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK mapfil.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK mapchk.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK prlst2.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK xstop.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK pairup.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK gexit.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK igdiff.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK lstcnt.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK lstind.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK pfft.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK pfft3d.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK prfft3.F
mcfftr.F:93:0: note: basic block vectorized
mcfftr.F:113:0: note: basic block vectorized
mrfftr.F:101:0: note: loop vectorized
mrfftr.F:101:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK prfft.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK prffti.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK chk3d.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK mfftc1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK mfftr1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK mcfftr.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK mrfftr.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK pfft1i.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK pfft1.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DFILE_IO -DIBM -DTCGMSG -DFFTPACK wrkspc2.F
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/pfft'
make[4]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/pfft'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a blktrn.o drain.o fillup.o mapfil.o mapchk.o prlst2.o xstop.o pairup.o gexit.o igdiff.o lstcnt.o lstind.o pfft.o pfft3d.o prfft3.o prfft.o prffti.o chk3d.o mfftc1.o mfftr1.o mcfftr.o mrfftr.o pfft1i.o pfft1.o wrkspc2.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
make[4]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/pfft'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0/pfft'
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0'
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0'
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfft1.0'
Making all in pfftwrap
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfftwrap'
nwfft3d.F:240:0: note: loop vectorized
nwfft3d.F:240:0: note: loop peeled for vectorization to enhance alignment
nwfft3d.F:270:0: note: loop vectorized
nwfft3d.F:270:0: note: loop peeled for vectorization to enhance alignment
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfftwrap'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DEMSLFFT nwfft3d.F
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfftwrap'
make[3]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfftwrap'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a nwfft3d.o
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/libpfft.a
make[3]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfftwrap'
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft/pfftwrap'
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft'
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft'
make[1]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/fft'
Making libraries in 64to32blas
make[1]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/64to32blas'
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/64to32blas'
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yscal.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ycopy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ydot.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygemm.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygemv.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG iyamax.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygesv.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygesvd.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yaxpy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yspsvx.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yposv.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ysyev.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yger.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yrot.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylaset.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yswap.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygebak.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygebal.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ynrm2.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylacpy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylascl.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylange.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ytrevc.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yhseqr.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yorghr.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygehrd.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ysterf.F
ylarnv.F:15:0: note: basic block vectorized
ylagtf.F:19:0: note: loop vectorized
ylagtf.F:19:0: note: loop peeled for vectorization to enhance alignment
ylagts.F:19:0: note: loop vectorized
ylagts.F:19:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylarnv.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylagtf.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ylagts.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG yasum.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec ypotri.f
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec ypotrf.f
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ysygv.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygeev.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ygeevx.F
ifily.F:9:0: note: loop vectorized
ifily.F:9:0: note: loop peeled for vectorization to enhance alignment
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ifily.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG xscal.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG xaxpy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG xgemm.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG xheev.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG xcopy.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG xdotc.F
ftn -c -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -ffast-math -Wuninitialized -fno-aggressive-loop-optimizations -O3 -mfpmath=sse -ffast-math -fprefetch-loop-arrays -ftree-vectorize -fopt-info-vec -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG ixamax.F
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/64to32blas'
make[2]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/64to32blas'
Got lock on /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/lib64to32.lock
ar r /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/lib64to32.a yscal.o ycopy.o ydot.o ygemm.o ygemv.o iyamax.o ygesv.o ygesvd.o yaxpy.o yspsvx.o yposv.o ysyev.o yger.o yrot.o ylaset.o yswap.o ygebak.o ygebal.o ynrm2.o ylacpy.o ylascl.o ylange.o ytrevc.o yhseqr.o yorghr.o ygehrd.o ysterf.o ylarnv.o ylagtf.o ylagts.o yasum.o ypotri.o ypotrf.o ysygv.o ygeev.o ygeevx.o ifily.o xscal.o xaxpy.o xgemm.o xheev.o xcopy.o xdotc.o ixamax.o
ar: creating /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/lib64to32.a
echo /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/lib64to32.a
/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64/lib64to32.a
make[2]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/64to32blas'
make[1]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/64to32blas'
make nwchem.o stubs.o
make[1]: Entering directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src'
ftn -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -g -fno-aggressive-loop-optimizations -g -O -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DCOMPILATION_DATE="'`date +%a_%b_%d_%H:%M:%S_%Y`'" -DCOMPILATION_DIR="'/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6'" -DNWCHEM_BRANCH="'6.6'" -c -o nwchem.o nwchem.F
ftn -m64 -ffast-math -Warray-bounds -fdefault-integer-8 -march=native -mtune=native -finline-functions -O2 -g -fno-aggressive-loop-optimizations -g -O -I. -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/include -I/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/include -I/opt/cray/papi/5.4.1.3/include -DCRAYXT -DNOIO -DGFORTRAN -DCHKUNDFLW -DGCC4 -DGCC46 -DEXT_INT -DLINUX -DLINUX64 -DUSE_PAPI -DSCALAPACK -DNOIO -DEAFHACK -DPARALLEL_DIAG -DCOMPILATION_DATE="'`date +%a_%b_%d_%H:%M:%S_%Y`'" -DCOMPILATION_DIR="'/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6'" -DNWCHEM_BRANCH="'6.6'" -c -o stubs.o stubs.F
make[1]: Leaving directory `/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src'
ftn -L/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/lib/LINUX64 -L/mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/src/tools/install/lib -o /mnt/a/u/system/bwjenkins/nwchem-spp/nwchem-6.6/bin/LINUX64/nwchem nwchem.o stubs.o -lnwctask -lccsd -lmp2 -lmoints -lstepper -ldriver -loptim -lnwdft -lgradients -lcphf -lddscf -lguess -lhessian -lvib -lnwcutil -lrimp2 -lproperty -lsolvation -lnwints -lnwpw -lofpw -lpaw -lpspw -lband -lnwpwlib -lpfft -lpspw -lnwcutil -lga -larmci -lpeigs -lperfm -lcons -lbq -lnwcutil -L/opt/cray/papi/5.4.1.3/lib -lpapi -l64to32 -lsci_gnu -lnwclapack -lnwcblas
ls -l ~/nwchem-spp/nwchem-6.6/bin/LINUX64/nwchem
echo "#!/bin/bash" > nwchem.pbs
echo "#PBS -j oe" >> nwchem.pbs
echo "#PBS -lnodes=100:ppn=32" >> nwchem.pbs
echo "#PBS -lwalltime=00:30:00" >> nwchem.pbs
echo "#PBS -N z05" >> nwchem.pbs
echo "cd $PBS_O_WORKDIR" >> nwchem.pbs
echo "cp ~arnoldg/spp/flops.nw ." >> nwchem.pbs
echo "aprun -n 800 -N 8 -d 4 ~/nwchem-spp/nwchem-6.6/bin/LINUX64/nwchem flops.nw.ccsd flops.nw > job.t.out" >> nwchem.pbs
echo "tail -100 job.t.out" >> nwchem.pbs
echo "grep cpu: job.t.out" >> nwchem.pbs
cat -n nwchem.pbs
MYJOBID=`qsub nwchem.pbs`
qsub nwchem.pbs
/bin/rm -f nwchem.o stubs.o
-rwxr-xr-x 1 bwjenkins BW_System 108762077 Nov 8 16:18 /u/system/bwjenkins/nwchem-spp/nwchem-6.6/bin/LINUX64/nwchem
1 #!/bin/bash
2 #PBS -j oe
3 #PBS -lnodes=100:ppn=32
4 #PBS -lwalltime=00:30:00
5 #PBS -N z05
6 cd
7 cp ~arnoldg/spp/flops.nw .
8 aprun -n 800 -N 8 -d 4 ~/nwchem-spp/nwchem-6.6/bin/LINUX64/nwchem flops.nw.ccsd flops.nw > job.t.out
9 tail -100 job.t.out
10 grep cpu: job.t.out
Job submitted to account: jnc
echo MYJOBID=$MYJOBID
~arnoldg/ior/wait_for.sh $MYJOBID
MYJOBID=5732726.bw
=== RUNNING /u/staff/arnoldg/ior/wait_for.sh ===
Tue Nov 8 16:19:00 CST 2016: waiting for 5732726.bw to finish
Tue Nov 8 16:24:00 CST 2016: waiting for 5732726.bw to finish
Tue Nov 8 16:29:01 CST 2016: waiting for 5732726.bw to finish
qstat: Unknown Job Id Error 5732726.bw
5732726.bw finished
[SSH] exit-status: 0
Finished: SUCCESS
![[Jenkins]](/static/755cd4af/images/svgs/logo.svg){kind=logo}
