Match Correlation energy
Commits >
Commit a4341ac9f169107ec4cef5019cc6269df7c401ac >
Run cmake_foss_2022a_min_mpi >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-3.387863790000000e+00 | -3.387863770000000e+00 | 1.690000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Correlation =', 3)