Input 16-bomd.02-td.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058173966828875e+01 |
-1.058173966727793e+01 |
1.110000000000000e-09 |
-1.010819872249158e-09 |
PASS |
| Energy [step 2] |
-1.058158908445419e+01 |
-1.058158908323673e+01 |
1.340000000000000e-09 |
-1.217463463376589e-09 |
PASS |
| Energy [step 3] |
-1.058145774227805e+01 |
-1.058145773976834e+01 |
2.760000000000000e-09 |
-2.509706220621410e-09 |
PASS |
| Energy [step 4] |
-1.058134610370155e+01 |
-1.058134609837270e+01 |
6.140000000000000e-09 |
-5.328844920882148e-09 |
PASS |
| Forces [step 1] |
-1.538478572155693e-01 |
-1.538477490161332e-01 |
1.190000000000000e-07 |
-1.081994360774274e-07 |
PASS |
| Forces [step 2] |
-1.732216535538152e-01 |
-1.732217491278016e-01 |
1.050000000000000e-07 |
9.557398641946158e-08 |
PASS |
| Forces [step 3] |
-1.918267217282998e-01 |
-1.918264519326440e-01 |
2.970000000000000e-07 |
-2.697956558439518e-07 |
PASS |
| Forces [step 4] |
-2.092291798230456e-01 |
-2.092290824096458e-01 |
1.470000000000000e-07 |
-9.741339984659092e-08 |
PASS |