Input 01-propagators.04-etrs_lanczos.inp
Commits >
Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 >
Run foss_ppc_autotools: [foss2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766758e+01 | -1.060686608766762e+01 | 1.060000000000000e-13 | 4.263256414560601e-14 | PASS |
| Energy [step 20] | -1.060637200596971e+01 | -1.060637200596971e+01 | 1.060000000000000e-13 | 1.776356839400250e-15 | PASS |
| Multipoles [step 0] | 2.750317185909630e-15 | 5.879834888021430e-16 | 4.510000000000000e-15 | 2.162333697107487e-15 | PASS |
| Multipoles [step 20] | -1.265864295118581e-01 | -1.265864295118224e-01 | 6.900000000000000e-14 | -3.566591466608315e-14 | PASS |
| Forces [step 0] | 8.537673799433065e-02 | 8.537673799433354e-02 | 1.250000000000000e-14 | -2.886579864025407e-15 | PASS |
| Forces [step 20] | 7.967423673801255e-02 | 7.967423673803031e-02 | 4.640000000000000e-14 | -1.776356839400250e-14 | PASS |