Match External energy
Commits >
Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 >
Run cmake_foss_2022a_full_serial >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-5.378242050000000e+01 | -5.378242078000000e+01 | 3.030000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'External =', 3)