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The Journal of Chemical Physics|March 3, 2005
Multireference second-order perturbation theory: how size consistent is "almost size consistent"Jamie M Rintelman, Ivana Adamovic, Sergey Varganov, et al.Physical Chemistry Chemical Physics : PCCP|October 6, 2021
Bonding analysis of water clusters using quasi-atomic orbitalsJorge L Galvez Vallejo, Juan Duchimaza Heredia, Mark S GordonThe Journal of Chemical Physics|July 17, 2009
A combined effective fragment potential-fragment molecular orbital method. I. The energy expression and initial applicationsTakeshi Nagata, Dmitri G Fedorov, Kazuo Kitaura, et al.The Journal of Physical Chemistry. A|November 28, 2018
A Quasi-Atomic Analysis of Three-Center Two-Electron Zr-H-Si InteractionsJuan J Duchimaza Heredia, Aaron D Sadow, Mark S GordonThe Journal of Physical Chemistry. A|June 15, 2019
Quasi-Atomic Bond Analyses in the Sixth Period: II. Bond Analyses of Cerium OxidesGeorge Schoendorff, Michael W Schmidt, Klaus Ruedenberg, et al.The Journal of Physical Chemistry. A|January 13, 2006
Modeling styrene-styrene interactionsIvana Adamovic, Hui Li, Monica H Lamm, et al.Journal of Chemical Theory and Computation|December 18, 2024
Systematic Investigation of Electronic States and Bond Properties of LnO, LnO+, LnS, and LnS+ (Ln = La-Lu) by Spin-Orbit Multiconfiguration Perturbation TheoryTaiji Nakamura, George Schoendorff, Dong-Sheng Yang, et al.The Journal of Physical Chemistry. A|February 6, 2007
Theoretical study of the pyrolysis of methyltrichlorosilane in the gas phase. 1. ThermodynamicsYingbin Ge, Mark S Gordon, Francine Battaglia, et al.The Journal of Physical Chemistry. A|July 29, 2011
Solvent-induced shift of the lowest singlet π → π* charge-transfer excited state of p-nitroaniline in water: an application of the TDDFT/EFP1 methodSarom Sok, Soohaeng Y Willow, Federico Zahariev, et al.The Journal of Physical Chemistry. A|December 27, 2023
R-8 Dispersion Interaction: Derivation and Application to the Effective Fragment Potential MethodPeng Xu, Samuel L Leonard, William O'Brien, et al.Pageof 25