Match comparison for B3LYP OEP Correlation (match type 12233)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-2.734403300000000e-01 | 3.280000000000000e-06 | -2.734428453846154e-01 | 1.587831687382382e-06 | -2.734403250000000e-01 | 2.985000000010896e-06 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.27344033, precision: 0.00000328Run | Value | Difference | Relative difference | Status |
foss-2022a_ppc | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
cmake_foss_2022a_full_serial | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
cmake_foss_2022a_min_serial | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
cmake_foss_2022a_full_mpi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
eb_fosscuda-2022a | -2.734373400000000e-01 | 2.990000000036019e-06 | 9.115853658646401e-01 | PASS |
cmake_foss_2022a_min_mpi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
eb_foss-2022a | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
eb_foss-2022a_debug | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
eb_foss-2022b_libxc6 | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
eb_foss-2022a_mpi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
foss-2022a_opt | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
foss-2022a_omp | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
eb_foss-2022b_libxc6_mpi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
intel-2022a | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
eb_foss-2022a_mpi_debug | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
intel-2022b | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
eb_fosscuda-2022a_mpi_omp | -2.734373500000000e-01 | 2.979999999985772e-06 | 9.085365853615158e-01 | PASS |
spack_foss-2022a_serial | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
intel-2022a_omp | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
intel-2022a_impi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
spack_foss-2022a_serial_min | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
foss-2022a_mpi_omp | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
intel-2022b_impi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |
spack_foss-2022a_serial_debug | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
spack_foss-2022a_serial_omp | -2.734433000000000e-01 | -2.969999999991035e-06 | -9.054878048753157e-01 | PASS |
intel-2022a_omp_impi | -2.734433100000000e-01 | -2.979999999985772e-06 | -9.085365853615158e-01 | PASS |