Match comparison for Total energy (match type 30492)

Commits > Commit 69bdc22e524ab1df7701119670aff9b913714e90 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184216894050000e+02 7.430000000000000e-05 -3.184216908660606e+02 1.825957597493565e-05 -3.184216663550000e+02 4.451500001323438e-05 PASS

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Detailed information

Reference: -318.421689405, precision: 0.0000743
Run Value Difference Relative difference Status
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216953400000e+02 -5.934999990131473e-06 -7.987886931536303e-02 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184216910800000e+02 -1.675000021350570e-06 -2.254374187551238e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.184216924400000e+02 -3.035000020190637e-06 -4.084791413446348e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.184216957600000e+02 -6.354999982249865e-06 -8.553162829407623e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184216924400000e+02 -3.035000020190637e-06 -4.084791413446348e-02 PASS
foss_autotools: [foss2022a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184216944700000e+02 -5.064999982096197e-06 -6.816958253157734e-02 PASS
foss_autotools: [foss2023b-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-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184216949200000e+02 -5.514999998013081e-06 -7.422611033664982e-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: [foss2022a-mpi] -3.184216956600000e+02 -6.255000016608392e-06 -8.418573373631752e-02 PASS
intel_autotools: [intel2023a-serial] -3.184217039300000e+02 -1.452499998322310e-05 -1.954912514565693e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184216951800000e+02 -5.774999976893014e-06 -7.772543710488578e-02 PASS
foss-serial-min: [foss2022a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
foss-serial-min: [foss2023b-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184216957500000e+02 -6.345000031160453e-06 -8.539703945034256e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
foss-serial-min: [foss2023a-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
intel_omp_autotools: [intel2022a-serial] -3.184216950900000e+02 -5.685000019184372e-06 -7.651413215591348e-02 PASS
intel_omp_autotools: [intel2023a-serial] -3.184216907200000e+02 -1.315000019985746e-06 -1.769851978446495e-02 PASS
foss-serial-debug: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184216801300000e+02 9.274999968056363e-06 1.248317626925486e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216946000000e+02 -5.195000028379582e-06 -6.991924668074807e-02 PASS
foss-omp-full: [foss2023a-serial] -3.184217055100000e+02 -1.610499998605519e-05 -2.167563928136634e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216954200000e+02 -6.014999996750703e-06 -8.095558542060165e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184216952300000e+02 -5.825000016557169e-06 -7.839838514881789e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184216950500000e+02 -5.644999987453048e-06 -7.597577372076780e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184216932900000e+02 -3.885000012360251e-06 -5.228802170067633e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184217108700000e+02 -2.146500003163965e-05 -2.888963665092819e-01 PASS