Match Hartree energy
Commits >
Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 >
Run spack_foss-2022a_cuda_serial >
Input 13-primitive.02-graphene.inp
Value | Reference | Precision | Status |
-1.128227453000000e+01 | -1.128227461000000e+01 | 8.799999999999999e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)