Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Matches
Name | Value | Reference | Precision | Difference | Status |
M-solvent int. energy @ t=0 | -3.215432382877718e+00 | -3.215432382877802e+00 | 4.120000000000000e-13 | 8.437694987151190e-14 | PASS |
M-solvent int. energy @ t=5*dt | -3.215432384511150e+00 | -3.215432384511066e+00 | 2.800000000000000e-13 | -8.437694987151190e-14 | PASS |