Match Mag.-opt. Re alpha w=0.0
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi] >
Input 02-h2o_pol_lr.05_h2o_magn_opt.inp
Value | Reference | Precision | Status |
-3.534978600000000e-03 | -3.534978700000000e-03 | 1.770000000000000e-09 | PASS |
Command: GREPFIELD(em_resp/freq_0.0000/alpha_mo, 'Re alpha', 4)