The activation enthalpy, activation entropy, and activation Gibbs free energy of H4-PTZ are calculated. Gaussian16 system was used to enhance the molecular framework, look for the transition point out and calculate the intrinsic reaction coordinates of H4-PTZ. Quite possibly the most possible decomposition path of H4-PTZ was observed, and also https://infigratinib11098.blogsidea.com/29613329/r-fundamentals-explained