Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058125198646847e+01 |
-1.058125197929708e+01 |
8.700000000000000e-09 |
-7.171394145188970e-09 |
PASS |
| Energy [step 2] |
-1.058226791352883e+01 |
-1.058226790610678e+01 |
8.160000000000000e-09 |
-7.422046977012542e-09 |
PASS |
| Energy [step 3] |
-1.058222764330490e+01 |
-1.058222763507127e+01 |
9.060000000000000e-09 |
-8.233628889797728e-09 |
PASS |
| Energy [step 4] |
-1.058219876277278e+01 |
-1.058219875382902e+01 |
9.840000000000001e-09 |
-8.943761287127927e-09 |
PASS |
| Forces [step 1] |
-2.249842027942648e-01 |
-2.249842127905284e-01 |
1.150000000000000e-08 |
9.996263650169368e-09 |
PASS |
| Forces [step 2] |
-2.378812300259839e-01 |
-2.378811867300932e-01 |
1.360000000000000e-07 |
-4.329589070595219e-08 |
PASS |
| Forces [step 3] |
-2.490670308659091e-01 |
-2.490668206371630e-01 |
1.070000000000000e-06 |
-2.102287460781227e-07 |
PASS |
| Forces [step 4] |
-2.574380412851744e-01 |
-2.574373063428386e-01 |
1.840000000000000e-06 |
-7.349423358227192e-07 |
PASS |