Match comparison for Hartree energy (match type 28834)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 1.647640595000000e+01 | 1.320000000000000e-02 | 1.648727137541667e+01 | 4.771909793500798e-03 | 1.647634835000000e+01 | 1.195957000000014e-02 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 16.47640595, precision: 0.0132| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| cmake_foss_2022a_full_mpi | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| cmake_foss_2022a_min_serial | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| cmake_foss_2022a_min_mpi | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| spack_foss-2022a_serial_min | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| spack_foss-2022a_serial | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| spack_foss-2022a_mpi_min | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| spack_foss-2022a_mpi | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| spack_foss-2023a_mpi_min | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| spack_foss-2023a_mpi | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| spack_foss-2023a_serial | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| spack_foss-2023a_mpi_opt | 1.648830698000000e+01 | 1.190103000000065e-02 | 9.015931818182307e-01 | PASS |
| spack_foss-2023a_serial_min | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| spack_foss-2023a_serial_opt | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| spack_foss-2023a_serial_omp | 1.648802127000000e+01 | 1.161532000000065e-02 | 8.799484848485342e-01 | PASS |
| spack_foss-2023a_mpi_omp | 1.648826772000000e+01 | 1.186176999999944e-02 | 8.986189393938969e-01 | PASS |
| spack_foss-2023b_serial | 1.648830792000000e+01 | 1.190197000000026e-02 | 9.016643939394138e-01 | PASS |
| spack_intel-2022a_serial_omp | 1.648823057000000e+01 | 1.182461999999873e-02 | 8.958045454544493e-01 | PASS |
| spack_intel-2023a_serial | 1.648823132000000e+01 | 1.182537000000039e-02 | 8.958613636363932e-01 | PASS |
| spack_intel-2023a_serial_omp | 1.648821977000000e+01 | 1.181382000000042e-02 | 8.949863636363954e-01 | PASS |
| spack_intel-2023a_impi | 1.648823132000000e+01 | 1.182537000000039e-02 | 8.958613636363932e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 1.646438878000000e+01 | -1.201717000000002e-02 | -9.103916666666683e-01 | PASS |
| spack_foss-2022a_cuda_serial | 1.648807804000000e+01 | 1.167209000000113e-02 | 8.842492424243283e-01 | PASS |
| spack_intel-2022a_impi_omp | 1.648823200000000e+01 | 1.182604999999981e-02 | 8.959128787878644e-01 | PASS |