Match Partial charge 55
Commits >
Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c >
Run eb_fosscuda-2022a >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
4.001000000000000e+00 | 4.001000000000000e+00 | 2.000000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 56)