Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058122525102483e+01 |
-1.058122524391890e+01 |
7.820000000000000e-09 |
-7.105930066586552e-09 |
PASS |
| Energy [step 2] |
-1.058224116954270e+01 |
-1.058224116264840e+01 |
7.900000000000000e-09 |
-6.894305570881443e-09 |
PASS |
| Energy [step 3] |
-1.058220090179187e+01 |
-1.058220089493070e+01 |
8.400000000000001e-09 |
-6.861165857685592e-09 |
PASS |
| Energy [step 4] |
-1.058217202407188e+01 |
-1.058217201622326e+01 |
8.890000000000001e-09 |
-7.848615979355600e-09 |
PASS |
| Forces [step 1] |
-2.249921734767634e-01 |
-2.249921820564550e-01 |
9.450000000000000e-09 |
8.579691568311176e-09 |
PASS |
| Forces [step 2] |
-2.378889070521000e-01 |
-2.378889438721823e-01 |
4.830000000000000e-08 |
3.682008231642442e-08 |
PASS |
| Forces [step 3] |
-2.490726024510641e-01 |
-2.490739460340152e-01 |
1.480000000000000e-06 |
1.343582951091049e-06 |
PASS |
| Forces [step 4] |
-2.574435121857120e-01 |
-2.574437451703678e-01 |
2.180000000000000e-06 |
2.329846557902471e-07 |
PASS |