Match Partial charge 60
Commits >
Commit d6f4833c99197407842d58e82c91c418d3d73b88 >
Run spack_foss-2023a_mpi_omp >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.998000000000000e+00 | 3.998000000000000e+00 | 2.000000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 61)