Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058125198645429e+01 |
-1.058125197929708e+01 |
8.700000000000000e-09 |
-7.157209935826359e-09 |
PASS |
| Energy [step 2] |
-1.058226791296237e+01 |
-1.058226790610678e+01 |
8.160000000000000e-09 |
-6.855589873566714e-09 |
PASS |
| Energy [step 3] |
-1.058222764055069e+01 |
-1.058222763507127e+01 |
9.060000000000000e-09 |
-5.479424913801267e-09 |
PASS |
| Energy [step 4] |
-1.058219875857084e+01 |
-1.058219875382902e+01 |
9.840000000000001e-09 |
-4.741821157949744e-09 |
PASS |
| Forces [step 1] |
-2.249842031290019e-01 |
-2.249842127905284e-01 |
1.150000000000000e-08 |
9.661526467752424e-09 |
PASS |
| Forces [step 2] |
-2.378811138827109e-01 |
-2.378811867300932e-01 |
1.360000000000000e-07 |
7.284738226531751e-08 |
PASS |
| Forces [step 3] |
-2.490665965774050e-01 |
-2.490668206371630e-01 |
1.230000000000000e-06 |
2.240597579972192e-07 |
PASS |
| Forces [step 4] |
-2.574356372750579e-01 |
-2.574373063428386e-01 |
2.150000000000000e-06 |
1.669067780707412e-06 |
PASS |