Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058122523680646e+01 |
-1.058122524391890e+01 |
7.820000000000000e-09 |
7.112443967116633e-09 |
PASS |
| Energy [step 2] |
-1.058224115550421e+01 |
-1.058224116264840e+01 |
7.900000000000000e-09 |
7.144185687479876e-09 |
PASS |
| Energy [step 3] |
-1.058220088789811e+01 |
-1.058220089493070e+01 |
8.400000000000001e-09 |
7.032594950828752e-09 |
PASS |
| Energy [step 4] |
-1.058217201015858e+01 |
-1.058217201622326e+01 |
8.890000000000001e-09 |
6.064681201678468e-09 |
PASS |
| Forces [step 1] |
-2.249921906440790e-01 |
-2.249921820564550e-01 |
9.450000000000000e-09 |
-8.587624056310972e-09 |
PASS |
| Forces [step 2] |
-2.378889668199644e-01 |
-2.378889438721823e-01 |
5.830000000000000e-08 |
-2.294778214673165e-08 |
PASS |
| Forces [step 3] |
-2.490737607397505e-01 |
-2.490739460340152e-01 |
1.480000000000000e-06 |
1.852942646818345e-07 |
PASS |
| Forces [step 4] |
-2.574444821350473e-01 |
-2.574437451703678e-01 |
2.180000000000000e-06 |
-7.369646795596374e-07 |
PASS |