Input 02-propagators.02-cnsparskit.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_opt_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433643e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 2.886579864025407e-15 | PASS |
| Forces [step 20] | 7.964959635257385e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -1.956768080901838e-15 | PASS |
| Energy [step 1] | -1.060686608766761e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 8.881784197001252e-15 | PASS |
| Energy [step 20] | -1.060637261154881e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
| Multipoles [step 1] | -7.786503985530469e-16 | 1.772521460662560e-15 | 3.200000000000000e-15 | -2.551171859215607e-15 | PASS |
| Multipoles [step 20] | -1.265304528942193e-01 | -1.265304528942186e-01 | 5.890000000000000e-15 | -6.661338147750939e-16 | PASS |