Match Hartree energy
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run cmake_foss_2022a_full_serial >
Input 13-primitive.02-graphene.inp
Value | Reference | Precision | Status |
-1.128227469000000e+01 | -1.128227461000000e+01 | 8.799999999999999e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)