Input 05-time_propagation.05-td_md.inp
Commits >
Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 >
Run foss-cmake-zen4: [foss2023a-serial, foss-min]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 1] | -3.791009280177376e+01 | -3.791009280177000e+01 | 1.900000000000000e-10 | -3.765876499528531e-12 | PASS |
Energy [step 5] | -3.791008856892487e+01 | -3.791008856893000e+01 | 1.900000000000000e-10 | 5.130118552187923e-12 | PASS |
Energy [step 10] | -3.791001520298109e+01 | -3.791001520298000e+01 | 1.900000000000000e-10 | -1.087130385712953e-12 | PASS |