Match Polarizability ZZ w=0.1
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] >
Input 06-h2o_pol_lr.04_emresp_mo.inp
Value | Reference | Precision | Status |
0.000000000000000e+00 | 1.092309400000000e+01 | 5.460000000000000e-06 | FAIL |
Command: LINEFIELD(em_resp/freq_0.1000/alpha, 4, 3)