Match comparison for Bader value 2 (match type 31093)
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
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 | -5.938004748165578e-02 | 1.165049750434160e-14 | -5.938004748164920e-02 | 3.049990815462422e-14 | PASS |
Checks for this match
- GPU builders have different values. Intel® builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.0593800303068332, precision: 0.0000000189| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -5.938004748167970e-02 | -1.717484650332057e-08 | -9.087220372127287e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -5.938004748165570e-02 | -1.717482250168656e-08 | -9.087207672850032e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -5.938004748166360e-02 | -1.717483040508672e-08 | -9.087211854543236e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -5.938004748166490e-02 | -1.717483170265988e-08 | -9.087212541089882e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -5.938004748167810e-02 | -1.717484490043608e-08 | -9.087219524040254e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -5.938004748165500e-02 | -1.717482180085828e-08 | -9.087207302041416e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -5.938004748165400e-02 | -1.717482080165755e-08 | -9.087206773363784e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -5.938004748167650e-02 | -1.717484330449048e-08 | -9.087218679624595e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -5.938004748161870e-02 | -1.717478550350426e-08 | -9.087188097092203e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -5.938004748163730e-02 | -1.717480409973993e-08 | -9.087197936370331e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -5.938004748163350e-02 | -1.717480030416496e-08 | -9.087195928129609e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -5.938004748166930e-02 | -1.717483610191861e-08 | -9.087214868740006e-01 | PASS |