Match comparison for Exchange energy (match type 23861)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-3.308255894000000e+01 | 4.000000000000000e-07 | -3.308255893800001e+01 | 7.477967677835100e-08 | -3.308255894000000e+01 | 1.400000009255109e-07 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -33.08255894, precision: 0.0000004Run | Value | Difference | Relative difference | Status |
foss-2022a_ppc | -3.308255908000000e+01 | -1.400000044782246e-07 | -3.500000111955615e-01 | PASS |
eb_fosscuda-2022a | -3.308255905000000e+01 | -1.100000019960135e-07 | -2.750000049900336e-01 | PASS |
cmake_foss_2022a_full_serial | -3.308255884000000e+01 | 1.000000011686097e-07 | 2.500000029215244e-01 | PASS |
cmake_foss_2022a_full_mpi | -3.308255896000000e+01 | -2.000000165480742e-08 | -5.000000413701855e-02 | PASS |
cmake_foss_2022a_min_serial | -3.308255884000000e+01 | 1.000000011686097e-07 | 2.500000029215244e-01 | PASS |
cmake_foss_2022a_min_mpi | -3.308255896000000e+01 | -2.000000165480742e-08 | -5.000000413701855e-02 | PASS |
eb_foss-2022a | -3.308255893000000e+01 | 1.000000082740371e-08 | 2.500000206850927e-02 | PASS |
eb_foss-2022a_debug | -3.308255893000000e+01 | 1.000000082740371e-08 | 2.500000206850927e-02 | PASS |
eb_foss-2022b_libxc6 | -3.308255896000000e+01 | -2.000000165480742e-08 | -5.000000413701855e-02 | PASS |
foss-2022a_opt | -3.308255893000000e+01 | 1.000000082740371e-08 | 2.500000206850927e-02 | PASS |
eb_foss-2022a_mpi | -3.308255902000000e+01 | -7.999999951380232e-08 | -1.999999987845058e-01 | PASS |
foss-2022a_omp | -3.308255890000000e+01 | 3.999999620418748e-08 | 9.999999051046871e-02 | PASS |
eb_foss-2022b_libxc6_mpi | -3.308255904000000e+01 | -1.000000011686097e-07 | -2.500000029215244e-01 | PASS |
intel-2022a | -3.308255901000000e+01 | -6.999999868639861e-08 | -1.749999967159965e-01 | PASS |
foss-2022a_mpi_omp | -3.308255893000000e+01 | 1.000000082740371e-08 | 2.500000206850927e-02 | PASS |
eb_foss-2022a_mpi_debug | -3.308255902000000e+01 | -7.999999951380232e-08 | -1.999999987845058e-01 | PASS |
intel-2022b | -3.308255901000000e+01 | -6.999999868639861e-08 | -1.749999967159965e-01 | PASS |
intel-2022a_omp | -3.308255891000000e+01 | 2.999999537678377e-08 | 7.499998844195943e-02 | PASS |
eb_fosscuda-2022a_mpi_omp | -3.308255893000000e+01 | 1.000000082740371e-08 | 2.500000206850927e-02 | PASS |
spack_foss-2022a_serial | -3.308255884000000e+01 | 1.000000011686097e-07 | 2.500000029215244e-01 | PASS |
intel-2022a_impi | -3.308255891000000e+01 | 2.999999537678377e-08 | 7.499998844195943e-02 | PASS |
spack_foss-2022a_serial_min | -3.308255884000000e+01 | 1.000000011686097e-07 | 2.500000029215244e-01 | PASS |
spack_foss-2022a_serial_omp | -3.308255897000000e+01 | -3.000000248221113e-08 | -7.500000620552782e-02 | PASS |
spack_foss-2022a_serial_debug | -3.308255884000000e+01 | 1.000000011686097e-07 | 2.500000029215244e-01 | PASS |
intel-2022a_omp_impi | -3.308255880000000e+01 | 1.399999973727972e-07 | 3.499999934319931e-01 | PASS |