Match comparison for gga_x_optpbe_vdw Exchange (match type 12340)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-3.146356050000000e-01 | 3.900000000000000e-06 | -3.146391384615385e-01 | 9.880948132233820e-09 | -3.146391400000000e-01 | 9.999999994736442e-09 | PASS |
Checks for this match
- MPI builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.314635605, precision: 0.0000039Run | Value | Difference | Relative difference | Status |
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_opt_autotools: [foss2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss-cmake: [foss2022a-serial, foss-min] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss-cmake: [foss2022a-serial, foss-full] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_intel_autotools: [intel2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_omp_autotools: [foss2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_intel_mpi_autotools: [intel2023a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_intel_omp_autotools: [intel2022a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_intel_omp_autotools: [intel2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_ppc_autotools: [foss2022a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_min_autotools: [foss2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_min_autotools: [foss2022a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_autotools: [foss2022a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_autotools: [foss2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_min_autotools: [foss2023b-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_autotools: [foss2023b-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_debug_autotools: [foss2023a-serial] | -3.146391300000000e-01 | -3.525000000004219e-06 | -9.038461538472357e-01 | PASS |
GCI_foss_mpi_min_autotools: [foss2022a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_mpi_min_autotools: [foss2023a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_mpi_autotools: [foss2023a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_mpi_autotools: [foss2022a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | -3.146391500000000e-01 | -3.544999999993692e-06 | -9.089743589727416e-01 | PASS |