Match comparison for Total energy (match type 30492)

Commits > Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184216894050000e+02 7.430000000000000e-05 -3.184216908762500e+02 1.815219610445428e-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: [foss2022a-serial, foss-min] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
foss_min_autotools: [foss2022a-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_min_autotools: [foss2023b-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_min_autotools: [foss2023a-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: [foss2022a-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_opt_autotools: [foss2023a-serial] -3.184217010400000e+02 -1.163500002121509e-05 -1.565948858844561e-01 PASS
intel_autotools: [intel2023a-serial] -3.184217039300000e+02 -1.452499998322310e-05 -1.954912514565693e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184216956100000e+02 -6.204999976944237e-06 -8.351278569238542e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184216945700000e+02 -5.165000004581088e-06 -6.951547785438880e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.184216218400000e+02 6.756499999482912e-05 9.093539703207150e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184216218400000e+02 6.756499999482912e-05 9.093539703207150e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216944800000e+02 -5.074999990029028e-06 -6.830417214036376e-02 PASS
foss_omp_autotools: [foss2023a-serial] -3.184217055100000e+02 -1.610499998605519e-05 -2.167563928136634e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184216957100000e+02 -6.304999999429128e-06 -8.485868101519688e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216920700000e+02 -2.665000010892982e-06 -3.586810243462963e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.184216950900000e+02 -5.685000019184372e-06 -7.651413215591348e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184216953100000e+02 -5.905000023176399e-06 -7.947510125405650e-02 PASS
intel_omp_autotools: [intel2023a-serial] -3.184216907200000e+02 -1.315000019985746e-06 -1.769851978446495e-02 PASS
foss_debug_autotools: [foss2023a-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_mpi_autotools: [foss2022a-mpi] -3.184216958700000e+02 -6.465000012667588e-06 -8.701211322567412e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184216955400000e+02 -6.134999978257838e-06 -8.257065919593322e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184216951500000e+02 -5.745000009937939e-06 -7.732166904357926e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216957900000e+02 -6.385000006048358e-06 -8.593539712043551e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184216956600000e+02 -6.255000016608392e-06 -8.418573373631752e-02 PASS
foss_cmake_ceph: [foss2022a-mpi, foss-min-mpi] -3.184216948200000e+02 -5.415000032371609e-06 -7.288021577889109e-02 PASS
foss_cmake_ceph: [foss2023a-mpi, foss-min-mpi] -3.184216957800000e+02 -6.374999998115527e-06 -8.580080751164908e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184216951800000e+02 -5.774999976893014e-06 -7.772543710488578e-02 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184216910800000e+02 -1.675000021350570e-06 -2.254374187551238e-02 PASS