Match comparison for Exchange energy (match type 25789)

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Input 18-TiO2.02-gs_kerker.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.132403024000000e+01 1.570000000000000e-07 -3.132403022799999e+01 4.000000330967795e-09 -3.132403022500000e+01 5.000000413701855e-09 PASS

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Detailed information

Reference: -31.32403024, precision: 0.000000157
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_min_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_min_autotools: [foss2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_min_autotools: [foss2023b-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_autotools: [foss2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_autotools: [foss2023b-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
intel_autotools: [intel2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_opt_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.132403022000000e+01 1.999999810209374e-08 1.273885229432722e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.132403022000000e+01 1.999999810209374e-08 1.273885229432722e-01 PASS
foss_omp_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.132403022000000e+01 1.999999810209374e-08 1.273885229432722e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.132403022000000e+01 1.999999810209374e-08 1.273885229432722e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.132403022000000e+01 1.999999810209374e-08 1.273885229432722e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_debug_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.132403022000000e+01 1.999999810209374e-08 1.273885229432722e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS