Match comparison for B3LYP Fock Correlation (match type 12227)

Commits > Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 > Input 03-xc.b3lyp_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.734403300000000e-01 3.280000000000000e-06 -2.734433046875000e-01 4.990224816958151e-09 -2.734433050000000e-01 4.999999997368221e-09 PASS

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Detailed information

Reference: -0.27344033, precision: 0.00000328
Run Value Difference Relative difference Status
foss-serial-debug: [foss2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss-omp-full: [foss2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss-mpi-min: [foss2022a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_autotools: [foss2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_autotools: [foss2022a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_autotools: [foss2023b-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
intel_autotools: [intel2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss-serial-min: [foss2022a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -2.734433100000000e-01 -2.979999999985772e-06 -9.085365853615158e-01 PASS
foss-serial-min: [foss2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss-serial-min: [foss2023b-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
foss-opt-full: [foss2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.734433000000000e-01 -2.969999999991035e-06 -9.054878048753157e-01 PASS