Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058122523680680e+01 |
-1.058122524391890e+01 |
7.820000000000000e-09 |
7.112099353889789e-09 |
PASS |
| Energy [step 2] |
-1.058224115549602e+01 |
-1.058224116264840e+01 |
7.900000000000000e-09 |
7.152376468866350e-09 |
PASS |
| Energy [step 3] |
-1.058220088780352e+01 |
-1.058220089493070e+01 |
8.400000000000001e-09 |
7.127184176169976e-09 |
PASS |
| Energy [step 4] |
-1.058217200999306e+01 |
-1.058217201622326e+01 |
8.890000000000001e-09 |
6.230203908330623e-09 |
PASS |
| Forces [step 1] |
-2.249921906427188e-01 |
-2.249921820564550e-01 |
9.450000000000000e-09 |
-8.586263838816777e-09 |
PASS |
| Forces [step 2] |
-2.378889653886905e-01 |
-2.378889438721823e-01 |
4.830000000000000e-08 |
-2.151650821402562e-08 |
PASS |
| Forces [step 3] |
-2.490740552005874e-01 |
-2.490739460340152e-01 |
1.480000000000000e-06 |
-1.091665722263713e-07 |
PASS |
| Forces [step 4] |
-2.574437971793896e-01 |
-2.574437451703678e-01 |
2.180000000000000e-06 |
-5.200902181146105e-08 |
PASS |