Match Hartree energy
Commits >
Commit 68887e7ef149674fa38f143e8d88a44249e6d867 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 08-benzene_supercell.01-gs.inp
Value | Reference | Precision | Status |
3.146027821000000e+01 | 3.146027821000000e+01 | 1.570000000000000e-09 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)