Input 10-bomd.02-td.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 1] |
-1.058173966828877e+01 |
-1.058173966727794e+01 |
1.110000000000000e-09 |
-1.010828754033355e-09 |
PASS |
| Energy [step 2] |
-1.058158908445421e+01 |
-1.058158908323670e+01 |
1.340000000000000e-09 |
-1.217509648654413e-09 |
PASS |
| Energy [step 3] |
-1.058145774227820e+01 |
-1.058145773976836e+01 |
2.760000000000000e-09 |
-2.509837671027526e-09 |
PASS |
| Energy [step 4] |
-1.058134610393217e+01 |
-1.058134609837600e+01 |
6.140000000000000e-09 |
-5.556168858333876e-09 |
PASS |
| Forces [step 1] |
-1.538478572155736e-01 |
-1.538477490161310e-01 |
1.190000000000000e-07 |
-1.081994426277433e-07 |
PASS |
| Forces [step 2] |
-1.732216535538764e-01 |
-1.732217491278353e-01 |
1.050000000000000e-07 |
9.557395888593057e-08 |
PASS |
| Forces [step 3] |
-1.918267217502022e-01 |
-1.918264519676630e-01 |
2.970000000000000e-07 |
-2.697825392528053e-07 |
PASS |
| Forces [step 4] |
-2.092292132266755e-01 |
-2.092290828484236e-01 |
1.480000000000000e-07 |
-1.303782518613517e-07 |
PASS |