Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058122525102841e+01 |
-1.058122524391890e+01 |
7.820000000000000e-09 |
-7.109512978331622e-09 |
PASS |
| Energy [step 2] |
-1.058224116952432e+01 |
-1.058224116264840e+01 |
7.900000000000000e-09 |
-6.875918501236811e-09 |
PASS |
| Energy [step 3] |
-1.058220090186164e+01 |
-1.058220089493070e+01 |
8.400000000000001e-09 |
-6.930942930694073e-09 |
PASS |
| Energy [step 4] |
-1.058217202425243e+01 |
-1.058217201622326e+01 |
8.890000000000001e-09 |
-8.029166664869081e-09 |
PASS |
| Forces [step 1] |
-2.249921734807187e-01 |
-2.249921820564550e-01 |
9.450000000000000e-09 |
8.575736287763647e-09 |
PASS |
| Forces [step 2] |
-2.378888996840801e-01 |
-2.378889438721823e-01 |
4.830000000000000e-08 |
4.418810214956714e-08 |
PASS |
| Forces [step 3] |
-2.490736609283406e-01 |
-2.490739460340152e-01 |
1.480000000000000e-06 |
2.851056745689640e-07 |
PASS |
| Forces [step 4] |
-2.574427404094227e-01 |
-2.574437451703678e-01 |
2.180000000000000e-06 |
1.004760945111371e-06 |
PASS |