Match Initial energy
Commits >
Commit 9bb80dbc43fc7b1ccbcadf899a686fb8cb0164a9 >
Run intel-2022b_impi >
Input 13-absorption-spin.01-gs.inp
Value | Reference | Precision | Status |
-6.134127260000000e+00 | -6.134127260000000e+00 | 3.070000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)