Match comparison for Born charge diff w=-0.2 (match type 17717)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.558670000000000e-01 | 7.790000000000000e-06 | -1.558675483870967e-01 | 8.362246062470118e-07 | -1.558670000000000e-01 | 1.000000000001000e-06 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -0.155867, precision: 0.00000779| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | -1.558680000000000e-01 | -1.000000000001000e-06 | -1.283697047498075e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.558660000000000e-01 | 1.000000000001000e-06 | 1.283697047498075e-01 | PASS |