Match comparison for Total energy (match type 30492)

Commits > Commit 18848dd43b1805cec78813204483223eec09e06c > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184216894050000e+02 7.430000000000000e-05 -3.184216906740625e+02 1.820657862778737e-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-min] -3.184216924400000e+02 -3.035000020190637e-06 -4.084791413446348e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184216924400000e+02 -3.035000020190637e-06 -4.084791413446348e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.184216948600000e+02 -5.455000007259514e-06 -7.341857344898403e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184216951000000e+02 -5.695000027117203e-06 -7.664872176469990e-02 PASS
foss_min_autotools: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_min_autotools: [foss2022a-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: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184216218400000e+02 6.756499999482912e-05 9.093539703207150e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.184216927000000e+02 -3.294999999070569e-06 -4.434724090269945e-02 PASS
foss_min_autotools: [foss2023b-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_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
foss_cmake: [foss2022a-serial, foss-full] -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_mpi_min_autotools: [foss2023a-mpi] -3.184216218400000e+02 6.756499999482912e-05 9.093539703207150e-01 PASS
foss_omp_autotools: [foss2023a-serial] -3.184217055100000e+02 -1.610499998605519e-05 -2.167563928136634e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184216893800000e+02 2.500001983207767e-08 3.364740219660520e-04 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184216954800000e+02 -6.074999987504270e-06 -8.176312230826743e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184216944700000e+02 -5.064999982096197e-06 -6.816958253157734e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184216957600000e+02 -6.354999982249865e-06 -8.553162829407623e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216942300000e+02 -4.825000019081926e-06 -6.493943498091422e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216948500000e+02 -5.444999999326683e-06 -7.328398384019762e-02 PASS
intel_omp_autotools: [intel2023a-serial] -3.184216907200000e+02 -1.315000019985746e-06 -1.769851978446495e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.184216950900000e+02 -5.685000019184372e-06 -7.651413215591348e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184216949900000e+02 -5.584999996699480e-06 -7.516823683310202e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184216945500000e+02 -5.144999988715426e-06 -6.924629863681596e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184217032800000e+02 -1.387499997917985e-05 -1.867429337709266e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184216954800000e+02 -6.074999987504270e-06 -8.176312230826743e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184216937300000e+02 -4.325000020344305e-06 -5.820995989696238e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216895800000e+02 -1.750000251377060e-07 -2.355316623656877e-03 PASS