Input 32-tdpcm_methane.03-td_prop_eom.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run foss-2022a_ppc

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -1.501578001374104e-02 -1.495587625573000e-02 1.000000000000000e-04 -5.990375801103592e-05 PASS
M-solvent int. energy @ t=21*dt -1.508541481008943e-02 -1.502587164251000e-02 1.000000000000000e-04 -5.954316757943341e-05 PASS
Compare to other inputs