Match Correlation energy
Commits >
Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 >
Run spack_foss-2023a_serial_omp >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-3.387894210000000e+00 | -3.387894220000000e+00 | 1.690000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Correlation =', 3)