Match Hartree energy
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run intel_omp_autotools: [intel2023a-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867580000e+03 | 3.954895868660000e+03 | 9.079999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)