Match comparison for Bader value 2 (match type 31093)
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Input 08-symmetrization_mgga.01-spg3_sym.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-5.938003030683320e-02 | 1.890000000000000e-08 | -5.938004748163721e-02 | 3.967952811960750e-15 | -5.938004748163615e-02 | 9.148931612301681e-15 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -0.0593800303068332, precision: 0.0000000189Run | Value | Difference | Relative difference | Status |
foss-ppc: [foss2022a-serial] | -5.938004748163550e-02 | -1.717480230256641e-08 | -9.087196985484870e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | -5.938004748162700e-02 | -1.717479380242137e-08 | -9.087192488053636e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | -5.938004748163880e-02 | -1.717480559854101e-08 | -9.087198729386777e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | -5.938004748164290e-02 | -1.717480969942731e-08 | -9.087200899167887e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | -5.938004748163820e-02 | -1.717480500179613e-08 | -9.087198413648748e-01 | PASS |
foss-serial-full: [foss2023a-serial] | -5.938004748163980e-02 | -1.717480660468063e-08 | -9.087199261735781e-01 | PASS |
intel_omp_autotools: [intel2022a-serial] | -5.938004748163180e-02 | -1.717479860413595e-08 | -9.087195028643362e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | -5.938004748163730e-02 | -1.717480409973993e-08 | -9.087197936370331e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | -5.938004748163980e-02 | -1.717480660468063e-08 | -9.087199261735781e-01 | PASS |
foss-serial-full: [foss2023b-serial] | -5.938004748163980e-02 | -1.717480660468063e-08 | -9.087199261735781e-01 | PASS |
foss-opt-full: [foss2023a-serial] | -5.938004748163980e-02 | -1.717480660468063e-08 | -9.087199261735781e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | -5.938004748163440e-02 | -1.717480119928227e-08 | -9.087196401736654e-01 | PASS |
intel-serial: [intel2023a-serial] | -5.938004748164530e-02 | -1.717481210028460e-08 | -9.087202169462750e-01 | PASS |
foss-omp-full: [foss2023a-serial] | -5.938004748163590e-02 | -1.717480270502225e-08 | -9.087197198424471e-01 | PASS |
foss-mpi-opt-full: [foss2023a-mpi] | -5.938004748163650e-02 | -1.717480330176713e-08 | -9.087197514162502e-01 | PASS |
foss-mpi-full: [foss2023a-mpi] | -5.938004748163650e-02 | -1.717480330176713e-08 | -9.087197514162502e-01 | PASS |
foss-mpi-debug: [foss2023a-mpi] | -5.938004748163650e-02 | -1.717480330176713e-08 | -9.087197514162502e-01 | PASS |
foss-mpi-omp-full: [foss2023a-mpi] | -5.938004748163700e-02 | -1.717480380136749e-08 | -9.087197778501317e-01 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | -5.938004748163480e-02 | -1.717480160173812e-08 | -9.087196614676254e-01 | PASS |
foss-serial-min: [foss2023a-serial] | -5.938004748164180e-02 | -1.717480860308207e-08 | -9.087200319091042e-01 | PASS |
foss-serial-min: [foss2023b-serial] | -5.938004748164180e-02 | -1.717480860308207e-08 | -9.087200319091042e-01 | PASS |
foss-serial-min: [foss2022a-serial] | -5.938004748164180e-02 | -1.717480860308207e-08 | -9.087200319091042e-01 | PASS |
foss-mpi-min: [foss2023a-mpi] | -5.938004748163250e-02 | -1.717479930496424e-08 | -9.087195399451978e-01 | PASS |
foss-mpi-min: [foss2022a-mpi] | -5.938004748163250e-02 | -1.717479930496424e-08 | -9.087195399451978e-01 | PASS |
cuda-serial: [foss2022a-cuda-mpi] | -5.938004748163630e-02 | -1.717480310053920e-08 | -9.087197407692701e-01 | PASS |
cuda-mpi-omp: [foss2022a-cuda-mpi] | -5.938004748163280e-02 | -1.717479960333668e-08 | -9.087195557320993e-01 | PASS |