Match Hartree energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run intel-min-parallel: [intel2022a-mpi] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867350000e+03 | 3.954895868660000e+03 | 9.079999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)