Match comparison for Difference Hartree potential (match type 21798)
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Input 10-hartree_pfft.02-fft_corrected.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 4.426524565815000e-01 | 3.330000000000000e-02 | 4.123857855782175e-01 | 9.614813431917819e-17 | 4.123857855782175e-01 | 2.775557561562891e-17 | PASS |
Checks for this match
- OpenMP builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 0.4426524565815, precision: 0.0333| Run | Value | Difference | Relative difference | Status |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | 4.123857855782174e-01 | -3.026667100328256e-02 | -9.089090391376144e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | 4.123857855782174e-01 | -3.026667100328256e-02 | -9.089090391376144e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | 4.123857855782174e-01 | -3.026667100328256e-02 | -9.089090391376144e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | 4.123857855782175e-01 | -3.026667100328251e-02 | -9.089090391376128e-01 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | 4.123857855782174e-01 | -3.026667100328256e-02 | -9.089090391376144e-01 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | 4.123857855782175e-01 | -3.026667100328251e-02 | -9.089090391376128e-01 | PASS |