Match Hartree energy
Commits >
Commit 9cd8be12b3755ae83838647d0fe27e1f4e47031c >
Run eb_foss-2022a_valgrind >
Input 28-carbon_big_box.01-ground_state.inp
Value | Reference | Precision | Status |
1.067930460000000e+00 | 1.067941250000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)