Match Kinetic energy
Commits >
Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 >
Run cmake_foss_2022a_min_mpi >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
9.517203660000000e+00 | 9.517203609999999e+00 | 4.760000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Kinetic =', 3)