Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058122525103061e+01 |
-1.058122524391890e+01 |
7.820000000000000e-09 |
-7.111710331741961e-09 |
PASS |
| Energy [step 2] |
-1.058224116954385e+01 |
-1.058224116264840e+01 |
7.900000000000000e-09 |
-6.895447768329177e-09 |
PASS |
| Energy [step 3] |
-1.058220090153281e+01 |
-1.058220089493070e+01 |
8.400000000000001e-09 |
-6.602107305297977e-09 |
PASS |
| Energy [step 4] |
-1.058217202359044e+01 |
-1.058217201622326e+01 |
8.890000000000001e-09 |
-7.367184196027665e-09 |
PASS |
| Forces [step 1] |
-2.249921734731619e-01 |
-2.249921820564550e-01 |
9.450000000000000e-09 |
8.583293076291909e-09 |
PASS |
| Forces [step 2] |
-2.378889058870793e-01 |
-2.378889438721823e-01 |
4.830000000000000e-08 |
3.798510303520963e-08 |
PASS |
| Forces [step 3] |
-2.490737103739762e-01 |
-2.490739460340152e-01 |
1.480000000000000e-06 |
2.356600390385211e-07 |
PASS |
| Forces [step 4] |
-2.574447646476496e-01 |
-2.574437451703678e-01 |
2.180000000000000e-06 |
-1.019477281816172e-06 |
PASS |