Input 32-tdpcm_methane.03-td_prop_eom.inp
Commits >
Commit 0c0a0ff03fa1c9b5e42984c9b7f40a807c9ec9b7 >
Run intel_omp_autotools: [intel2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -1.501569625158898e-02 | -1.495587625573000e-02 | 1.000000000000000e-04 | -5.981999585898470e-05 | PASS |
| M-solvent int. energy @ t=21*dt | -1.508533060255909e-02 | -1.502587164251000e-02 | 1.000000000000000e-04 | -5.945896004908892e-05 | PASS |