Match comparison for gga_x_optpbe_vdw Exchange (match type 12340)

Commits > Commit 968a3ff7080ffa1f89f08d37efc7416527769dec > Input 03-xc.gga_x_optpbe_vdw.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.146356050000000e-01 3.900000000000000e-06 -3.146386669999999e-01 1.767158076307294e-06 -3.146356000000000e-01 3.549999999991060e-06 PASS

Checks for this match

  • GPU builders have different values.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -0.314635605, precision: 0.0000039
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_min_autotools: [foss2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_min_autotools: [foss2023b-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_min_autotools: [foss2022a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_opt_autotools: [foss2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_autotools: [foss2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_autotools: [foss2023b-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_autotools: [foss2022a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
intel_autotools: [intel2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_omp_autotools: [foss2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -3.146391300000000e-01 -3.525000000004219e-06 -9.038461538472357e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.146320500000000e-01 3.554999999988429e-06 9.115384615354946e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.146320600000000e-01 3.544999999993692e-06 9.089743589727416e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.146391500000000e-01 -3.544999999993692e-06 -9.089743589727416e-01 PASS