Match comparison for Exchange energy (match type 30558)

Commits > Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 > Input 18-mgga.02-br89_oep.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.181949020000000e+00 1.030000000000000e-05 -2.181952607575758e+00 3.664091958577734e-06 -2.181950485000000e+00 7.895000000202046e-06 PASS

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Detailed information

Reference: -2.18194902, precision: 0.0000103
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.181953140000000e+00 -4.120000000273905e-06 -4.000000000265927e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.181953140000000e+00 -4.120000000273905e-06 -4.000000000265927e-01 PASS
foss-ppc: [foss2022a-serial] -2.181953180000000e+00 -4.160000000030806e-06 -4.038834951486219e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.181953140000000e+00 -4.120000000273905e-06 -4.000000000265927e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.181953140000000e+00 -4.120000000273905e-06 -4.000000000265927e-01 PASS
foss-serial-full: [foss2023a-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-serial-full: [foss2023b-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.181942590000000e+00 6.430000000001712e-06 6.242718446603605e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.181942590000000e+00 6.430000000001712e-06 6.242718446603605e-01 PASS
foss-serial-min: [foss2022a-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-serial-debug: [foss2023a-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-serial-min: [foss2023a-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-serial-min: [foss2023b-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-opt-full: [foss2023a-serial] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
intel-serial: [intel2023a-serial] -2.181955220000000e+00 -6.200000000067263e-06 -6.019417475793459e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.181955220000000e+00 -6.200000000067263e-06 -6.019417475793459e-01 PASS
foss-omp-full: [foss2023a-serial] -2.181955450000000e+00 -6.430000000001712e-06 -6.242718446603605e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-mpi-full: [foss2023a-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-mpi-min: [foss2022a-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.181953600000000e+00 -4.580000000142803e-06 -4.446601941886217e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -2.181955450000000e+00 -6.430000000001712e-06 -6.242718446603605e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.181942590000000e+00 6.430000000001712e-06 6.242718446603605e-01 PASS
valgrind: [foss2023a-serial] -2.181953120000000e+00 -4.100000000395454e-06 -3.980582524655781e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.181958380000000e+00 -9.360000000402380e-06 -9.087378641167360e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -2.181944900000000e+00 4.119999999829815e-06 3.999999999834772e-01 PASS