Match comparison for Hartree energy (match type 30882)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
6.827684844000001e+01 | 3.660000000000000e-06 | 6.827684749733334e+01 | 1.600674720309182e-06 | 6.827684801999999e+01 | 2.520000002448342e-06 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: 68.27684844000001, precision: 0.00000366Run | Value | Difference | Relative difference | Status |
foss_cmake: [foss2022a-serial, foss-min] | 6.827684856000000e+01 | 1.199999957179898e-07 | 3.278688407595350e-02 | PASS |
foss_min_autotools: [foss2022a-serial] | 6.827684856000000e+01 | 1.199999957179898e-07 | 3.278688407595350e-02 | PASS |
foss_cmake: [foss2022a-serial, foss-full] | 6.827684856000000e+01 | 1.199999957179898e-07 | 3.278688407595350e-02 | PASS |
foss_min_autotools: [foss2023a-serial] | 6.827684837000000e+01 | -7.000001289725333e-08 | -1.912568658394900e-02 | PASS |
foss_min_autotools: [foss2023b-serial] | 6.827684837000000e+01 | -7.000001289725333e-08 | -1.912568658394900e-02 | PASS |
foss_opt_autotools: [foss2023a-serial] | 6.827684837000000e+01 | -7.000001289725333e-08 | -1.912568658394900e-02 | PASS |
foss_autotools: [foss2022a-serial] | 6.827684856000000e+01 | 1.199999957179898e-07 | 3.278688407595350e-02 | PASS |
foss_autotools: [foss2023b-serial] | 6.827684837000000e+01 | -7.000001289725333e-08 | -1.912568658394900e-02 | PASS |
intel_autotools: [intel2023a-serial] | 6.827684667000000e+01 | -1.770000011447337e-06 | -4.836065605047368e-01 | PASS |
foss_autotools: [foss2023a-serial] | 6.827684837000000e+01 | -7.000001289725333e-08 | -1.912568658394900e-02 | PASS |
foss_cmake: [foss2022a-mpi, foss-min-mpi] | 6.827684549999999e+01 | -2.940000015883015e-06 | -8.032786928642118e-01 | PASS |
foss_cmake: [foss2023a-mpi, foss-min-mpi] | 6.827684565000000e+01 | -2.790000010577387e-06 | -7.622950848572095e-01 | PASS |
foss_mpi_min_autotools: [foss2022a-mpi] | 6.827684549999999e+01 | -2.940000015883015e-06 | -8.032786928642118e-01 | PASS |
foss_mpi_min_autotools: [foss2023a-mpi] | 6.827684565000000e+01 | -2.790000010577387e-06 | -7.622950848572095e-01 | PASS |
foss_cmake: [foss2022a-mpi, foss-full-mpi] | 6.827684549999999e+01 | -2.940000015883015e-06 | -8.032786928642118e-01 | PASS |
foss_cmake: [foss2023a-mpi, foss-full-mpi] | 6.827684565000000e+01 | -2.790000010577387e-06 | -7.622950848572095e-01 | PASS |
foss_debug_autotools: [foss2023a-serial] | 6.827684837000000e+01 | -7.000001289725333e-08 | -1.912568658394900e-02 | PASS |
foss_omp_autotools: [foss2023a-serial] | 6.827685006000000e+01 | 1.619999991930854e-06 | 4.426229486149874e-01 | PASS |
foss_mpi_opt_autotools: [foss2023a-mpi] | 6.827684565000000e+01 | -2.790000010577387e-06 | -7.622950848572095e-01 | PASS |
intel_omp_autotools: [intel2022a-serial] | 6.827684841999999e+01 | -2.000001586566214e-08 | -5.464485209197304e-03 | PASS |
intel_omp_autotools: [intel2023a-serial] | 6.827684662999999e+01 | -1.810000014756952e-06 | -4.945355231576370e-01 | PASS |
foss_mpi_autotools: [foss2022a-mpi] | 6.827684549999999e+01 | -2.940000015883015e-06 | -8.032786928642118e-01 | PASS |
foss_ppc_autotools: [foss2022a-serial] | 6.827684811000000e+01 | -3.300000059880404e-07 | -9.016393606230610e-02 | PASS |
foss_mpi_autotools: [foss2023a-mpi] | 6.827684565000000e+01 | -2.790000010577387e-06 | -7.622950848572095e-01 | PASS |
foss_mpi_debug_autotools: [foss2023a-mpi] | 6.827684565000000e+01 | -2.790000010577387e-06 | -7.622950848572095e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | 6.827684641000000e+01 | -2.030000004538124e-06 | -5.546448099830940e-01 | PASS |
foss_mpi_omp_autotools: [foss2023a-mpi] | 6.827684977000000e+01 | 1.329999989252428e-06 | 3.633879752055815e-01 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 6.827684794000000e+01 | -5.000000129484761e-07 | -1.366120253957585e-01 | PASS |
foss_cuda_autotools: [foss2022a-cuda-mpi] | 6.827685054000000e+01 | 2.099999989013668e-06 | 5.737704888015486e-01 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 6.827685001000000e+01 | 1.569999994899263e-06 | 4.289617472402357e-01 | PASS |