Match comparison for Hartree energy (match type 23579)
Commits >
Commit f1dbe11076ccb3bb542605fe66566061d8720041 >
Input 09-symmetrization_gga.01-spg143_nosym.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 3.166544000000000e-02 | 1.580000000000000e-07 | 3.166550999999999e-02 | 6.938893903907228e-18 | 3.166551000000000e-02 | 0.000000000000000e+00 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 0.03166544, precision: 0.000000158| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_ppc | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| cmake_foss_2022a_full_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| cmake_foss_2022a_min_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| cmake_foss_2022a_min_mpi | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| cmake_foss_2022a_full_mpi | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2022a_serial_min | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2022a_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2022a_mpi_min | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2022a_mpi | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_mpi | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_mpi_min | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_mpi_debug | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_serial_min | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2022a_cuda_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_mpi_opt | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_serial_debug | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_serial_opt | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023b_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_serial_omp | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_foss-2023a_mpi_omp | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_intel-2023a_serial | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_intel-2022a_serial_omp | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_intel-2023a_serial_omp | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_intel-2023a_impi | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |
| spack_intel-2022a_impi_omp | 3.166551000000000e-02 | 6.999999999784956e-08 | 4.430379746699339e-01 | PASS |