Match comparison for Force 1 (y) (match type 31099)
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Input 08-symmetrization_mgga.01-spg3_sym.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.923577940000000e-15 | 3.830000000000000e-15 | -1.304170114230769e-17 | 9.028358801924651e-21 | -1.303753115000000e-17 | 1.355254999999997e-20 | PASS |
Checks for this match
- Precision seems large and value close to zero. Should value be 0?
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.00000000000000192357794, precision: 0.00000000000000383| Run | Value | Difference | Relative difference | Status |
| foss-ppc: [foss2022a-serial] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| intel-serial: [intel2023a-serial] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.303753110000000e-17 | 1.910540408900000e-15 | 4.988356159007833e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -1.302397860000000e-17 | 1.910553961400000e-15 | 4.988391544125326e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -1.302397860000000e-17 | 1.910553961400000e-15 | 4.988391544125326e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -1.302397860000000e-17 | 1.910553961400000e-15 | 4.988391544125326e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -1.305108370000000e-17 | 1.910526856300000e-15 | 4.988320773629242e-01 | PASS |