Match Hartree energy
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run intel_omp_autotools: [intel2023a-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867580000e+03 | 3.954895868660000e+03 | 4.100000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)