Input 02-propagators.02-cnsparskit.inp
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run intel_autotools: [intel2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Forces [step 1] | 8.537673799433421e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | 6.661338147750939e-16 | PASS |
| Forces [step 20] | 7.964959635257385e-02 | 7.964959635257580e-02 | 7.040000000000000e-15 | -1.956768080901838e-15 | PASS |
| Energy [step 1] | -1.060686608766762e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 3.552713678800501e-15 | PASS |
| Energy [step 20] | -1.060637261154882e+01 | -1.060637261154880e+01 | 1.060000000000000e-13 | -1.421085471520200e-14 | PASS |
| Multipoles [step 1] | 1.783070700366995e-15 | 1.824331091466839e-16 | 4.490000000000000e-15 | 1.600637591220311e-15 | PASS |
| Multipoles [step 20] | -1.265304528942173e-01 | -1.265304528942171e-01 | 6.810000000000000e-15 | -1.942890293094024e-16 | PASS |