Input 10-bomd.03-td_restart.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058125197138787e+01 |
-1.058125197929708e+01 |
8.700000000000000e-09 |
7.909207511147542e-09 |
PASS |
| Energy [step 2] |
-1.058226789868861e+01 |
-1.058226790610678e+01 |
8.160000000000000e-09 |
7.418172742745810e-09 |
PASS |
| Energy [step 3] |
-1.058222762694903e+01 |
-1.058222763507127e+01 |
9.060000000000000e-09 |
8.122242434183136e-09 |
PASS |
| Energy [step 4] |
-1.058219874485263e+01 |
-1.058219875382902e+01 |
9.840000000000001e-09 |
8.976387633197191e-09 |
PASS |
| Forces [step 1] |
-2.249842232089281e-01 |
-2.249842127905284e-01 |
1.150000000000000e-08 |
-1.041839967075298e-08 |
PASS |
| Forces [step 2] |
-2.378813082171968e-01 |
-2.378811867300932e-01 |
1.360000000000000e-07 |
-1.214871036270271e-07 |
PASS |
| Forces [step 3] |
-2.490662666080736e-01 |
-2.490668206371630e-01 |
1.380000000000000e-06 |
5.540290894390232e-07 |
PASS |
| Forces [step 4] |
-2.574374565969620e-01 |
-2.574373063428386e-01 |
2.150000000000000e-06 |
-1.502541233655563e-07 |
PASS |