David B. Krisiloff

Size-extensivity-corrected multireference configuration interaction schemes to accurately predict bond dissociation energies of oxygenated hydrocarbons

Victor B. Oyeyemi, David B. Krisiloff, John A. Keith et al. · The Journal of Chemical Physics · 2014 · 97 citations

Engineering, Bond Dissociation Energies, Molecular Biology +16

Ab Initio Reaction Kinetics of Hydrogen Abstraction from Methyl Formate by Hydrogen, Methyl, Oxygen, Hydroxyl, and Hydroperoxy Radicals

Ting Tan, Michele Pavone, David B. Krisiloff et al. · The Journal of Physical Chemistry A · 2012 · 58 citations

Engineering, Fuel Science, Computational Chemistry +21

Approximately size extensive local multireference singles and doubles configuration interaction

David B. Krisiloff, Emily A. Carter · Physical Chemistry Chemical Physics · 2012 · 47 citations

Multi-reference Configuration Interaction, Engineering, Data Science +14

Bond Dissociation Energies of C₁₀and C₁₈Methyl Esters from Local Multireference Averaged-Coupled Pair Functional Theory

Victor B. Oyeyemi, Johannes M. Dieterich, David B. Krisiloff et al. · The Journal of Physical Chemistry A · 2015 · 29 citations · Full text

Engineering, Bond Dissociation Energies, Natural Sciences +13

Density Fitting and Cholesky Decomposition of the Two-Electron Integrals in Local Multireference Configuration Interaction Theory

David B. Krisiloff, Caroline M. Krauter, Francis J. Ricci et al. · Journal of Chemical Theory and Computation · 2015 · 19 citations

Engineering, Cholesky Decomposition, Computational Chemistry +17