Match Hartree energy
Commits >
Commit 9cd8be12b3755ae83838647d0fe27e1f4e47031c >
Run cmake_foss_2022a_full_mpi >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895210580000e+03 | 3.954895210660000e+03 | 4.180000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)