Partitioning Entropy with Action Mechanics: Predicting Chemical Reaction Rates and Gaseous Equilibria of Reactions of Hydrogen from Molecular Properties

Our intention is to provide easy methods for estimating entropy and chemical potentials for gas phase reactions. Clausius’ virial theorem set a basis for relating kinetic energy in a body of independent material particles to its potential energy, pointing to their complementary role with respect to...

Full description

Bibliographic Details
Main Authors: Ivan R. Kennedy, Migdat Hodzic
Format: Article
Published: MDPI AG 2021-08-01
Online Access: