Input 32-tdpcm_methane.02-td_prop_neq.inp

Commits > Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 > Run foss_cmake: [foss2023a-mpi, foss-full-mpi]

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -1.501569625178233e-02 -1.495587719231000e-02 1.000000000000000e-04 -5.981905947233246e-05 PASS
M-solvent int. energy @ t=21*dt -1.508530737291971e-02 -1.502584992053000e-02 1.000000000000000e-04 -5.945745238971310e-05 PASS
Compare to other inputs