Match comparison for Hartree energy (match type 30417)

Commits > Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b > Input 07-mgga.01-tb09_gs_symm.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.314588280000001e+00 2.160000000000000e-07 4.314588290000000e+00 0.000000000000000e+00 4.314588290000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: 4.314588280000001, precision: 0.000000216
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-serial-min: [foss2022a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-serial-min: [foss2023b-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-serial-full: [foss2023b-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-serial-min: [foss2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
intel-serial: [intel2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-opt-full: [foss2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-serial-full: [foss2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-serial-debug: [foss2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-ppc: [foss2022a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
intel-omp: [intel2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
intel-omp: [intel2022a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-mpi-full: [foss2023a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-omp-full: [foss2023a-serial] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-mpi-min: [foss2022a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-mpi-debug: [foss2023a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-mpi-min: [foss2023a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
foss-mpi-omp-full: [foss2023a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 4.314588290000000e+00 9.999999051046871e-09 4.629629190299477e-02 PASS