Match Unnormalized charge
Commits >
Commit a41c007d955b10e3b7368ff6ffc60ddf6399c944 >
Run intel_autotools: [intel2023a-serial] >
Input 17-hgh_occupations.03-W_sc.inp
Value | Reference | Precision | Status |
1.394376700000000e+01 | 1.394381700000000e+01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(out, 'Unnormalized total charge = ', 6)