Match Ion-ion energy
Commits >
Commit 0eb882d93dcc47f8554e98f5f256d6c6053dae9c >
Run spack_foss-2023a_mpi_omp >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| 1.315759358000000e+01 | 1.315759358000000e+01 | 6.579999999999999e-08 | PASS |
Command: GREPFIELD(static/info, 'Ion-ion =', 3)