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Journal of the American Chemical Society|August 30, 2008
Nanosolids, slushes, and nanoliquids: characterization of nanophases in metal clusters and nanoparticlesZhen Hua Li, Donald G TruhlarThe Journal of Chemical Physics|February 2, 2015
Improved methods for Feynman path integral calculations and their application to calculate converged vibrational-rotational partition functions, free energies, enthalpies, entropies, and heat capacities for methaneSteven L Mielke, Donald G TruhlarThe Journal of Physical Chemistry. B|July 21, 2006
Improved density functionals for waterErin E Dahlke, Donald G TruhlarThe Journal of Chemical Physics|March 3, 2005
Conical intersections and semiclassical trajectories: comparison to accurate quantum dynamics and analyses of the trajectoriesAhren W Jasper, Donald G TruhlarThe Journal of Physical Chemistry. A|March 18, 2009
Improved methods for Feynman path integral calculations of vibrational-rotational free energies and application to isotopic fractionation of hydrated chloride ionsSteven L Mielke, Donald G TruhlarThe Journal of Chemical Physics|November 27, 2007
Non-Born-Oppenheimer molecular dynamics of Na...FH photodissociationAhren W Jasper, Donald G TruhlarThe Journal of Chemical Physics|July 3, 2020
Semiglobal diabatic potential energy matrix for the N-H photodissociation of methylamineKelsey A Parker, Donald G TruhlarThe Journal of Physical Chemistry. B|June 15, 2006
Assessment of the pairwise additive approximation and evaluation of many-body terms for water clustersErin E Dahlke, Donald G TruhlarJournal of Chemical Theory and Computation|November 26, 2015
Performance of Density Functional Theory and Møller-Plesset Second-Order Perturbation Theory for Structural Parameters in Complexes of RuAnant D Kulkarni, Donald G TruhlarJournal of Chemical Theory and Computation|November 27, 2015
Electrostatically Embedded Many-Body Approximation for Systems of Water, Ammonia, and Sulfuric Acid and the Dependence of Its Performance on Embedding ChargesHannah R Leverentz, Donald G TruhlarPageof 1,194