Match comparison for Hartree-Fock external energy (match type 15656)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 4.529334900000000e-01 | 1.000000000000000e-04 | 4.529337699999999e-01 | 1.110223024625157e-16 | 4.529337700000000e-01 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 0.45293349, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_min_autotools: [foss2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_min_autotools: [foss2023b-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_min_autotools: [foss2022a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_autotools: [foss2022a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_autotools: [foss2023b-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| intel_autotools: [intel2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_autotools: [foss2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | 4.529337700000000e-01 | 2.800000000191538e-07 | 2.800000000191538e-03 | PASS |