Match comparison for Total energy (match type 30492)

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184216894050000e+02 7.430000000000000e-05 -3.184216902150000e+02 1.225550540062425e-05 -3.184216847000000e+02 1.944999999636821e-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] -3.184217016200000e+02 -1.221500002657194e-05 -1.644010770736466e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184217016200000e+02 -1.221500002657194e-05 -1.644010770736466e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184217041500000e+02 -1.474499998721512e-05 -1.984522205547123e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.184216946200000e+02 -5.214999987401825e-06 -7.018842513326816e-02 PASS
foss-serial-min: [foss2023b-serial] -3.184216652500000e+02 2.415500000552129e-05 3.251009422008249e-01 PASS
foss-serial-min: [foss2022a-serial] -3.184216652500000e+02 2.415500000552129e-05 3.251009422008249e-01 PASS
foss-serial-min: [foss2023a-serial] -3.184216652500000e+02 2.415500000552129e-05 3.251009422008249e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184216946200000e+02 -5.214999987401825e-06 -7.018842513326816e-02 PASS
foss-serial-full: [foss2023a-serial] -3.184216652500000e+02 2.415500000552129e-05 3.251009422008249e-01 PASS
foss-opt-full: [foss2023a-serial] -3.184216946200000e+02 -5.214999987401825e-06 -7.018842513326816e-02 PASS
intel-serial: [intel2023a-serial] -3.184216940100000e+02 -4.605000015089900e-06 -6.197846588277119e-02 PASS
foss-serial-full: [foss2023b-serial] -3.184216652500000e+02 2.415500000552129e-05 3.251009422008249e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.184216946100000e+02 -5.204999979468994e-06 -7.005383552448174e-02 PASS
foss-ppc: [foss2022a-serial] -3.184216968000000e+02 -7.395000011456432e-06 -9.952893689712559e-02 PASS
foss-serial-debug: [foss2023a-serial] -3.184216652500000e+02 2.415500000552129e-05 3.251009422008249e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216957500000e+02 -6.345000031160453e-06 -8.539703945034256e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216956100000e+02 -6.204999976944237e-06 -8.351278569238542e-02 PASS
intel-omp: [intel2023a-serial] -3.184216955900000e+02 -6.185000017921993e-06 -8.324360723986532e-02 PASS
intel-omp: [intel2022a-serial] -3.184216948900000e+02 -5.485000031058007e-06 -7.382234227534330e-02 PASS
foss-omp-full: [foss2023a-serial] -3.184216973300000e+02 -7.924999977149128e-06 -1.066621800423839e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.184216951200000e+02 -5.714999986139446e-06 -7.691790021722000e-02 PASS
foss-mpi-full: [foss2023a-mpi] -3.184216953100000e+02 -5.905000023176399e-06 -7.947510125405650e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184216942100000e+02 -4.805000003216264e-06 -6.467025576334137e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184216942100000e+02 -4.805000003216264e-06 -6.467025576334137e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] -3.184217003300000e+02 -1.092500002641827e-05 -1.470390313111477e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184216919200000e+02 -2.515000005587353e-06 -3.384925983293881e-02 PASS
foss-mpi-debug: [foss2023a-mpi] -3.184216955200000e+02 -6.115000019235595e-06 -8.230148074341312e-02 PASS
foss-mpi-min: [foss2023a-mpi] -3.184216933800000e+02 -3.975000026912312e-06 -5.349932741470137e-02 PASS
foss-mpi-min: [foss2022a-mpi] -3.184216933800000e+02 -3.975000026912312e-06 -5.349932741470137e-02 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.184216956600000e+02 -6.255000016608392e-06 -8.418573373631752e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216948100000e+02 -5.405000024438777e-06 -7.274562617010467e-02 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -3.184216956900000e+02 -6.284999983563466e-06 -8.458950179762403e-02 PASS