Wendell T. Duncan

TheRate: Program forab initio direct dynamics calculations of thermal and vibrational-state-selected rate constants

Wendell T. Duncan, Robert L. Bell, Thanh N. Truong · Journal of Computational Chemistry · 1998 · 281 citations · Full text

Engineering, Graphical User Interface, Computational Chemistry +21

Thermal and vibrational-state selected rates of the CH4+Cl↔HCl+CH3 reaction

Wendell T. Duncan, Thanh N. Truong · The Journal of Chemical Physics · 1995 · 159 citations

Engineering, Computational Chemistry, Chemistry +16

A new direct <i>ab initio</i> dynamics method for calculating thermal rate constants from density functional theory

Thanh N. Truong, Wendell T. Duncan · The Journal of Chemical Physics · 1994 · 89 citations

Dft Methods, Engineering, Computational Chemistry +21

A reaction class approach for modeling gas phase reaction rates

Thanh N. Truong, Wendell T. Duncan, Max Tirtowidjojo · Physical Chemistry Chemical Physics · 1999 · 82 citations

Engineering, Computational Chemistry, Reaction Class +19

Direct ab Initio Dynamics Studies of the Hydrogen Abstraction Reactions of Hydrogen Atom with Fluoromethanes

Dilip Kumar Maity, Wendell T. Duncan, Thanh N. Truong · The Journal of Physical Chemistry A · 1999 · 51 citations

Engineering, Theoretical Inorganic Chemistry, Computational Chemistry +18