Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058122525102817e+01 |
-1.058122524391890e+01 |
7.820000000000000e-09 |
-7.109271393801464e-09 |
PASS |
| Energy [step 2] |
-1.058224116957151e+01 |
-1.058224116264840e+01 |
7.900000000000000e-09 |
-6.923105644318639e-09 |
PASS |
| Energy [step 3] |
-1.058220090188640e+01 |
-1.058220089493070e+01 |
8.400000000000001e-09 |
-6.955700015964794e-09 |
PASS |
| Energy [step 4] |
-1.058217202416528e+01 |
-1.058217201622326e+01 |
8.890000000000001e-09 |
-7.942018598328104e-09 |
PASS |
| Forces [step 1] |
-2.249921734722591e-01 |
-2.249921820564550e-01 |
9.450000000000000e-09 |
8.584195881899959e-09 |
PASS |
| Forces [step 2] |
-2.378889133901846e-01 |
-2.378889438721823e-01 |
4.830000000000000e-08 |
3.048199764821291e-08 |
PASS |
| Forces [step 3] |
-2.490739327553122e-01 |
-2.490739460340152e-01 |
1.480000000000000e-06 |
1.327870299827616e-08 |
PASS |
| Forces [step 4] |
-2.574429706558390e-01 |
-2.574437451703678e-01 |
2.180000000000000e-06 |
7.745145287896271e-07 |
PASS |