Match comparison for Total energy (match type 2073)
Commits >
Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 >
Input 03-vdw_sternheimer.01-ground_state.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.844783760000000e+00 | 1.000000000000000e-04 | -2.844804580000000e+00 | 0.000000000000000e+00 | -2.844804580000000e+00 | 0.000000000000000e+00 | PASS |
Checks for this match
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Detailed information
Reference: -2.84478376, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_mpi_debug | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_mpi_omp | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| cmake_foss_2022a_min_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| cmake_foss_2022a_full_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| cmake_foss_2022a_min_mpi | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| cmake_foss_2022a_full_mpi | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_intel-2023a_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_intel-2022a_impi_omp | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_intel-2022a_serial_omp | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_intel-2023a_serial_omp | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_intel-2023a_impi | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_serial_min | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_serial_min | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_serial_opt | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023b_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_ppc | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_cuda_serial | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_mpi_min | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_mpi_min | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_serial_omp | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_serial_debug | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_mpi_opt | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2022a_mpi | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |
| spack_foss-2023a_mpi | -2.844804580000000e+00 | -2.082000000003248e-05 | -2.082000000003248e-01 | PASS |