John J. Determan

Toward Accurate Theoretical Thermochemistry of First Row Transition Metal Complexes

Wanyi Jiang, Nathan J. DeYonker, John J. Determan et al. · The Journal of Physical Chemistry A · 2011 · 167 citations · Full text

Engineering, Theoretical Inorganic Chemistry, Mean Absolute Deviations +16

Comparative Study of Nonhybrid Density Functional Approximations for the Prediction of 3d Transition Metal Thermochemistry

John J. Determan, Katelyn Poole, Giovanni Scalmani et al. · Journal of Chemical Theory and Computation · 2017 · 35 citations

Chemical Kinetics, Engineering, Material Simulation +16

Modeling the Photophysics of Zn and Cd Monomers, Metallophilic Dimers, and Covalent Excimers

John J. Determan, Mohammad A. Omary, Angela K. Wilson · The Journal of Physical Chemistry A · 2011 · 11 citations

Tunable Fictitious Substituent Effects on the π–π Interactions of Substituted Sandwich Benzene Dimers

Amee M. Garcia, John J. Determan, Benjamin G. Janesko · The Journal of Physical Chemistry A · 2014 · 10 citations

Simulating Gold’s Structure-Dependent Reactivity: Nonlocal Density Functional Theory Studies of Hydrogen Activation by Gold Clusters, Nanowires, and Surfaces

John J. Determan, Salvador Moncho, Edward N. Brothers et al. · The Journal of Physical Chemistry C · 2014 · 10 citations