Match Correlation energy
Commits >
Commit ad9fcbdd35c8d08e16e213263c476bba0afb770b >
Run spack_foss-2023a_mpi_min >
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)