Input 32-tdpcm_methane.03-td_prop_eom.inp

Commits > Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 > Run spack_intel-2023a_impi

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -1.501578001383771e-02 -1.495587625573000e-02 1.000000000000000e-04 -5.990375810771033e-05 PASS
M-solvent int. energy @ t=21*dt -1.508541481004110e-02 -1.502587164251000e-02 1.000000000000000e-04 -5.954316753109708e-05 PASS
Compare to other inputs