Match comparison for Total energy (match type 28444)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.239099407200000e+02 | 6.200000000000000e-08 | -1.239099407146154e+02 | 7.457967711752479e-09 | -1.239099407150000e+02 | 1.499999768839189e-08 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -123.90994072, precision: 0.000000062| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| foss-2022a_ppc | -1.239099407300000e+02 | -1.000000793283107e-08 | -1.612904505295334e-01 | PASS |
| spack_foss-2022a_serial_min | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| spack_foss-2022a_serial | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-2022a_opt | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| intel-2022b | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022a | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_mpi | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| spack_foss-2022a_serial_omp | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_debug | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| foss-2022a_omp | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| eb_fosscuda-2022a | -1.239099407300000e+02 | -1.000000793283107e-08 | -1.612904505295334e-01 | PASS |
| intel-2022a_omp | -1.239099407000000e+02 | 1.999998744395270e-08 | 3.225804426443984e-01 | PASS |
| intel-2022b_impi | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| intel-2022a_impi | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.239099407300000e+02 | -1.000000793283107e-08 | -1.612904505295334e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| foss-2022a_mpi_omp | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| eb_foss-2022b_libxc6 | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| eb_foss-2022a_debug | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| intel-2022a_omp_impi | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.239099407200000e+02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi_debug | -1.239099407100000e+02 | 9.999993721976352e-09 | 1.612902213221992e-01 | PASS |