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Journal of Computational Chemistry|March 5, 2016
A new approach for second-order perturbation theoryDavid G Tomlinson, Andrey Asadchev, Mark S GordonJournal of the American Chemical Society|July 15, 2020
Why is Si2H2 Not Linear? An Intrinsic Quasi-Atomic Bonding AnalysisEmilie B Guidez, Mark S Gordon, Klaus RuedenbergThe Journal of Physical Chemistry. A|July 3, 2018
Benchmarking of the R-7 Anisotropic Dispersion Energy Term on the S22 Dimer Test SetLuke Schoeberle, Emilie B Guidez, Mark S GordonThe Journal of Physical Chemistry. A|September 1, 2011
Effective fragment potential study of the interaction of DNA basesQuentin A Smith, Mark S Gordon, Lyudmila V SlipchenkoThe Journal of Physical Chemistry. B|June 15, 2006
Electronic structure studies of tetrazolium-based ionic liquidsDeborah D Zorn, Jerry A Boatz, Mark S GordonThe Journal of Physical Chemistry. A|June 14, 2013
Solvent induced shifts in the UV spectrum of amidesNuwan De Silva, Soohaeng Y Willow, Mark S GordonJournal of Computational Chemistry|October 29, 2018
Application of a semi-empirical dispersion correction for modeling water clustersNuwan De Silva, Matthew A Adreance, Mark S GordonThe Journal of Physical Chemistry. A|April 25, 2012
Geometry optimizations of open-shell systems with the fragment molecular orbital methodSpencer R Pruitt, Dmitri G Fedorov, Mark S GordonThe Journal of Physical Chemistry. A|July 13, 2006
Triazolium-based energetic ionic liquidsMichael W Schmidt, Mark S Gordon, Jerry A BoatzPhysical Chemistry Chemical Physics : PCCP|September 29, 2015
Ab initio investigation of the aqueous solvation of the nitrate ionSpencer R Pruitt, Kurt R Brorsen, Mark S GordonPageof 25