Match Hartree energy
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 13-j_dependent.01_O2.inp
Value | Reference | Precision | Status |
4.294088683000000e+01 | 4.294088683000000e+01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)