Match Hartree energy
Commits >
Commit 4ba8d1ba4a84cee910627f85cb1ba733d430c04d >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 28-mgga_kli.01-Si_scan.inp
Value | Reference | Precision | Status |
5.621437400000000e-01 | 5.621437400000000e-01 | 2.810000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)