Match comparison for Exchange energy (match type 25121)

Commits > Commit dfb998a08bfe04488932b5e2d20d2b9995cc9a79 > Input 12-boron_nitride.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.748179225000000e+02 1.160000000000000e-07 -1.748179225126666e+02 8.008052172391426e-08 -1.748179225050000e+02 1.050000122404526e-07 PASS
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Detailed information

Reference: -174.8179225, precision: 0.000000116
Run Value Difference Relative difference Status
foss-2022a_ppc -1.748179224300000e+02 6.999999868639861e-08 6.034482645379190e-01 PASS
cmake_foss_2022a_full_serial -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
foss-2022a_opt -1.748179224000000e+02 1.000000224848918e-07 8.620691593525156e-01 PASS
intel-2022a -1.748179226100000e+02 -1.100000019960135e-07 -9.482758792759780e-01 PASS
cmake_foss_2022a_full_mpi -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
cmake_foss_2022a_min_serial -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
foss-2022a_omp -1.748179224300000e+02 6.999999868639861e-08 6.034482645379190e-01 PASS
cmake_foss_2022a_min_mpi -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
eb_fosscuda-2022a -1.748179225600000e+02 -5.999999075356754e-08 -5.172412995997202e-01 PASS
intel-2022a_impi -1.748179226100000e+02 -1.100000019960135e-07 -9.482758792759780e-01 PASS
eb_foss-2022a -1.748179224000000e+02 1.000000224848918e-07 8.620691593525156e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.748179224200000e+02 8.000000661922968e-08 6.896552294761179e-01 PASS
eb_foss-2022a_debug -1.748179224000000e+02 1.000000224848918e-07 8.620691593525156e-01 PASS
eb_foss-2022b_libxc6 -1.748179224500000e+02 5.000001124244591e-08 4.310345796762578e-01 PASS
eb_foss-2022a_mpi -1.748179224000000e+02 1.000000224848918e-07 8.620691593525156e-01 PASS
foss-2022a_mpi_omp -1.748179224300000e+02 6.999999868639861e-08 6.034482645379190e-01 PASS
eb_foss-2022b_libxc6_mpi -1.748179224500000e+02 5.000001124244591e-08 4.310345796762578e-01 PASS
intel-2022b -1.748179226100000e+02 -1.100000019960135e-07 -9.482758792759780e-01 PASS
eb_foss-2022a_mpi_debug -1.748179224000000e+02 1.000000224848918e-07 8.620691593525156e-01 PASS
spack_foss-2022a_serial -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
intel-2022a_omp -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
spack_foss-2022a_mpi -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
spack_foss-2022a_serial_debug -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
spack_foss-2022a_serial_min -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
intel-2022b_impi -1.748179226100000e+02 -1.100000019960135e-07 -9.482758792759780e-01 PASS
spack_foss-2022a_serial_omp -1.748179225400000e+02 -4.000000330961484e-08 -3.448276147380590e-01 PASS
spack_foss-2022a_serial_opt -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
spack_foss-2022a_mpi_omp -1.748179225700000e+02 -6.999999868639861e-08 -6.034482645379190e-01 PASS
intel-2022a_omp_impi -1.748179225600000e+02 -5.999999075356754e-08 -5.172412995997202e-01 PASS
eb_foss-2022a_valgrind -1.748179224000000e+02 1.000000224848918e-07 8.620691593525156e-01 PASS