Match comparison for Exchange energy (match type 23861)

Commits > Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 > Input 25-Fe_polarized.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.308255894000000e+01 4.950000000000000e-07 -3.308255899923077e+01 7.893147318092310e-08 -3.308255899500000e+01 1.249999996844053e-07 PASS

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Detailed information

Reference: -33.08255894, precision: 0.000000495
Run Value Difference Relative difference Status
foss-ppc: [foss2022a-serial] -3.308255892000000e+01 2.000000165480742e-08 4.040404374708569e-02 PASS
foss-cmake-zen4: [foss2023a-serial, ci-foss-full] -3.308255898000000e+01 -4.000000330961484e-08 -8.080808749417139e-02 PASS
foss-cmake-zen4: [foss2023a-serial, ci-foss-min] -3.308255898000000e+01 -4.000000330961484e-08 -8.080808749417139e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] -3.308255900000000e+01 -6.000000496442226e-08 -1.212121312412571e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] -3.308255887000000e+01 6.999999868639861e-08 1.414141387604012e-01 PASS
foss-serial-full: [foss2023a-serial] -3.308255890000000e+01 3.999999620418748e-08 8.080807313977269e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.308255903000000e+01 -9.000000034120603e-08 -1.818181825074869e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.308255902000000e+01 -7.999999951380232e-08 -1.616161606339441e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.308255890000000e+01 3.999999620418748e-08 8.080807313977269e-02 PASS
foss-serial-full: [foss2023b-serial] -3.308255890000000e+01 3.999999620418748e-08 8.080807313977269e-02 PASS
foss-opt-full: [foss2023a-serial] -3.308255890000000e+01 3.999999620418748e-08 8.080807313977269e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.308255912000000e+01 -1.800000006824121e-07 -3.636363650149739e-01 PASS
intel-serial: [intel2023a-serial] -3.308255905000000e+01 -1.100000019960135e-07 -2.222222262545726e-01 PASS
foss-omp-full: [foss2023a-serial] -3.308255900000000e+01 -6.000000496442226e-08 -1.212121312412571e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.308255912000000e+01 -1.800000006824121e-07 -3.636363650149739e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.308255912000000e+01 -1.800000006824121e-07 -3.636363650149739e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -3.308255912000000e+01 -1.800000006824121e-07 -3.636363650149739e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.308255896000000e+01 -2.000000165480742e-08 -4.040404374708569e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.308255909000000e+01 -1.499999982002009e-07 -3.030302993943453e-01 PASS
foss-serial-min: [foss2023a-serial] -3.308255893000000e+01 1.000000082740371e-08 2.020202187354285e-02 PASS
foss-serial-min: [foss2023b-serial] -3.308255893000000e+01 1.000000082740371e-08 2.020202187354285e-02 PASS
foss-serial-min: [foss2022a-serial] -3.308255893000000e+01 1.000000082740371e-08 2.020202187354285e-02 PASS
foss-mpi-min: [foss2023a-mpi] -3.308255904000000e+01 -1.000000011686097e-07 -2.020202043810298e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.308255904000000e+01 -1.000000011686097e-07 -2.020202043810298e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -3.308255905000000e+01 -1.100000019960135e-07 -2.222222262545726e-01 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -3.308255908000000e+01 -1.400000044782246e-07 -2.828282918752011e-01 PASS