Input 01-cosh_2e_1d.02-td.inp
Commits >
Commit 4b6d45842a438d46c51308ffa6e74b875e60d9e9 >
Run foss_valgrind_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.271322167167137e+00 | -1.271322167167000e+00 | 1.000000000000000e-04 | -1.367794766338193e-13 | PASS |
| Energy [step 50] | -1.261322168663092e+00 | -1.261322168663000e+00 | 1.000000000000000e-04 | -9.148237722911290e-14 | PASS |
| Energy [step 100] | -1.261322168663117e+00 | -1.261322168663000e+00 | 1.000000000000000e-04 | -1.172395514004165e-13 | PASS |
| Energy [step 150] | -1.261322168663145e+00 | -1.261322168663000e+00 | 1.000000000000000e-04 | -1.452171716209705e-13 | PASS |
| Energy [step 200] | -1.261322168663177e+00 | -1.261322168663000e+00 | 1.000000000000000e-04 | -1.774136393351000e-13 | PASS |
| Density matrix [step 50] | 8.223000000000000e-01 | 8.223000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Density matrix [step 100] | 8.215000000000000e-01 | 8.215000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Density matrix [step 150] | 8.210000000000000e-01 | 8.210000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Density matrix [step 200] | 8.206000000000000e-01 | 8.206000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |