Match comparison for Exchange energy (orbitals) (match type 30563)

Commits > Commit 968a3ff7080ffa1f89f08d37efc7416527769dec > Input 18-mgga.02-br89_oep.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.181951000000000e+00 1.090000000000000e-05 -2.181954161290322e+00 2.033537743573234e-06 -2.181951500000000e+00 6.500000000020378e-06 PASS
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Detailed information

Reference: -2.181951, precision: 0.0000109
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_min_autotools: [foss2023a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_min_autotools: [foss2023b-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_min_autotools: [foss2022a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_opt_autotools: [foss2023a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_autotools: [foss2023a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_autotools: [foss2023b-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_autotools: [foss2022a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
intel_autotools: [intel2023a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_omp_autotools: [foss2023a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.181957000000000e+00 -5.999999999950489e-06 -5.504587155917879e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.181957000000000e+00 -5.999999999950489e-06 -5.504587155917879e-01 PASS
foss_debug_autotools: [foss2023a-serial] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -2.181956000000000e+00 -4.999999999810711e-06 -4.587155963129093e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -2.181945000000000e+00 6.000000000394579e-06 5.504587156325301e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -2.181954000000000e+00 -2.999999999975245e-06 -2.752293577958940e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.181958000000000e+00 -6.999999999646178e-06 -6.422018348299245e-01 PASS
foss_valgrind_autotools: [foss2023a-serial] -2.181953000000000e+00 -1.999999999835467e-06 -1.834862385170153e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.181957000000000e+00 -5.999999999950489e-06 -5.504587155917879e-01 PASS