Match comparison for Exchange energy (match type 25789)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 18-TiO2.02-gs_kerker.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.132403024000000e+01 1.570000000000000e-07 -3.132403023105264e+01 4.054111761337610e-09 -3.132403024000000e+01 9.999999051046871e-09 PASS
Checks do not indicate problems with this match.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -31.32403024, precision: 0.000000157
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] -3.132403025000000e+01 -1.000000082740371e-08 -6.369427278601089e-02 PASS
cmake_foss_2022a_full_serial -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_ppc -3.132403025000000e+01 -1.000000082740371e-08 -6.369427278601089e-02 PASS
spack_foss-2023a_serial_opt -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
cmake_foss_2022a_min_serial -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
cmake_foss_2022a_min_mpi -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
cmake_foss_2022a_full_mpi -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_mpi -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_mpi_min -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_serial -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_min_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_serial_min -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_serial -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_mpi_min -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_mpi -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_serial_min -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_mpi_opt -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_serial_debug -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023b_serial -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_serial_omp -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_mpi_debug -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_intel-2022a_serial_omp -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2023a_mpi_omp -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_intel-2023a_serial -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_intel-2023a_impi -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_intel-2023a_serial_omp -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_intel-2022a_impi_omp -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_cuda_mpi_omp -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS
spack_foss-2022a_cuda_serial -3.132403024000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -3.132403024000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.132403023000000e+01 9.999997274690031e-09 6.369425015726135e-02 PASS