Match comparison for Exchange energy (match type 28433)

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Input 13-primitive.03-bcc_iron.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.642299800000000e+01 8.209999999999999e-06 -1.642299817000000e+01 0.000000000000000e+00 -1.642299817000000e+01 0.000000000000000e+00 PASS
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Detailed information

Reference: -16.422998, precision: 0.00000821
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-serial-min: [foss2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-serial-min: [foss2022a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-serial-full: [foss2023b-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-serial-min: [foss2023b-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-opt-full: [foss2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-ppc: [foss2022a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-serial-full: [foss2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-serial-debug: [foss2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
intel_omp_autotools: [intel2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
intel_omp_autotools: [intel2022a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-omp-full: [foss2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-mpi-full: [foss2023a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
intel-serial: [intel2023a-serial] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-mpi-debug: [foss2023a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-mpi-min: [foss2022a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-mpi-min: [foss2023a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -1.642299817000000e+01 -1.699999998550084e-07 -2.070645552436156e-02 PASS