Match comparison for Hartree energy (match type 23860)

Commits > Commit f4bc596bdcf3afff33b833944576bfd5457df1bc > Input 25-Fe_polarized.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
6.510589381000000e+01 3.590000000000000e-06 6.510589439374999e+01 5.600209284731168e-07 6.510589427500000e+01 7.750000037276550e-07 PASS

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Detailed information

Reference: 65.10589381, precision: 0.00000359
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 6.510589498000000e+01 1.170000004435678e-06 3.259052937146736e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 6.510589442000000e+01 6.100000007336348e-07 1.699164347447451e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 6.510589457000000e+01 7.600000060392631e-07 2.116991660276499e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 6.510589374000000e+01 -6.999999868639861e-08 -1.949860687643415e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss-serial-min: [foss2022a-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss-serial-min: [foss2023a-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss-serial-min: [foss2023b-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss-opt-full: [foss2023a-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
intel-serial: [intel2023a-serial] 6.510589462000000e+01 8.100000030708543e-07 2.256267418024664e-01 PASS
foss-serial-full: [foss2023b-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss-serial-full: [foss2023a-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss-ppc: [foss2022a-serial] 6.510589398000000e+01 1.700000069604357e-07 4.735376238452248e-02 PASS
foss-serial-debug: [foss2023a-serial] 6.510589376999999e+01 -4.000000330961484e-08 -1.114206220323533e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
intel_omp_autotools: [intel2023a-serial] 6.510589349999999e+01 -3.100000043332329e-07 -8.635097613739079e-02 PASS
intel_omp_autotools: [intel2022a-serial] 6.510589403000000e+01 2.200000039920269e-07 6.128133815933897e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss-omp-full: [foss2023a-serial] 6.510589449000000e+01 6.799999994200334e-07 1.894150416211792e-01 PASS
foss-mpi-full: [foss2023a-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss-mpi-debug: [foss2023a-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 6.510589495000001e+01 1.140000009058895e-06 3.175487490414748e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] 6.510589410999999e+01 2.999999964004019e-07 8.356545860735429e-02 PASS
foss-mpi-min: [foss2023a-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss-mpi-min: [foss2022a-mpi] 6.510589505000000e+01 1.240000003122077e-06 3.454039005911078e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] 6.510589433000000e+01 5.200000003924288e-07 1.448467967666933e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 6.510589460000000e+01 7.900000014160469e-07 2.200557107008487e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 6.510589490000000e+01 1.089999997816449e-06 3.036211693082030e-01 PASS