Match Partial charge 1
Commits >
Commit 7ddcca10159cfd3a5f031627bc95daf6cfe3e221 >
Run spack_foss-2023a_serial >
Input 07-symmetrization_lda.01-spg2_sym.inp
Value | Reference | Precision | Status |
4.000000000000000e+00 | 4.000000000000000e+00 | 1.000000000000000e-01 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)