Match comparison for Total energy (match type 30492)

Commits > Commit ab5faecb27d88076e64ba8608dc3fc5641398a04 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184216894050000e+02 7.430000000000000e-05 -3.184216898864706e+02 1.814010520617058e-05 -3.184216636750000e+02 4.183499999044216e-05 PASS

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Detailed information

Reference: -318.421689405, precision: 0.0000743
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184216924400000e+02 -3.035000020190637e-06 -4.084791413446348e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.184216924400000e+02 -3.035000020190637e-06 -4.084791413446348e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184216957700000e+02 -6.364999990182696e-06 -8.566621790286266e-02 PASS
foss-serial-min: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
foss-serial-min: [foss2022a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
intel_autotools: [intel2023a-serial] -3.184217039300000e+02 -1.452499998322310e-05 -1.954912514565693e-01 PASS
foss-serial-min: [foss2023b-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss-opt-full: [foss2023a-serial] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
foss_autotools: [foss2022a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_autotools: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_autotools: [foss2023b-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.184216950400000e+02 -5.634999979520217e-06 -7.584118411198137e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216954200000e+02 -6.014999996750703e-06 -8.095558542060165e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.184216950900000e+02 -5.685000019184372e-06 -7.651413215591348e-02 PASS
foss-serial-debug: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss-omp-full: [foss2023a-serial] -3.184217055100000e+02 -1.610499998605519e-05 -2.167563928136634e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.184216907200000e+02 -1.315000019985746e-06 -1.769851978446495e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216944800000e+02 -5.074999990029028e-06 -6.830417214036376e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184216944300000e+02 -5.025000007208291e-06 -6.763122486148440e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184216944700000e+02 -5.064999982096197e-06 -6.816958253157734e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184216641500000e+02 2.525499996863800e-05 3.399057869264873e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184216910800000e+02 -1.675000021350570e-06 -2.254374187551238e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184216950700000e+02 -5.665000003318710e-06 -7.624495293834065e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184216953000000e+02 -5.895000015243568e-06 -7.934051164527009e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184216218400000e+02 6.756499999482912e-05 9.093539703207150e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.184216218400000e+02 6.756499999482912e-05 9.093539703207150e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184216949000000e+02 -5.494999982147419e-06 -7.395693111907697e-02 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184216891000000e+02 3.050000145776721e-07 4.104980007774860e-03 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184216951700000e+02 -5.765000025803602e-06 -7.759084826115210e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184216948700000e+02 -5.465000015192345e-06 -7.355316305777046e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184216956900000e+02 -6.284999983563466e-06 -8.458950179762403e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216953700000e+02 -5.965000013929966e-06 -8.028263814172229e-02 PASS