Input 32-tdpcm_methane.02-td_prop_neq.inp

Commits > Commit d6f4833c99197407842d58e82c91c418d3d73b88 > Run cmake_foss_2022a_min_serial

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -1.501578001383771e-02 -1.495587719231000e-02 1.000000000000000e-04 -5.990282152770927e-05 PASS
M-solvent int. energy @ t=21*dt -1.508539158016004e-02 -1.502584992053000e-02 1.000000000000000e-04 -5.954165963003612e-05 PASS
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