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Physical Chemistry Chemical Physics : PCCP|August 25, 2017
Challenges in bimetallic multilayer structure formation: Pt growth on Cu monolayers on Ru(0001)Luis A Mancera, Albert K Engstfeld, Andreas Bensch, et al.Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|November 10, 2011
Assessing spin-component-scaled second-order Møller-plesset theory using anharmonic frequenciesDominik Domin, David M BenoitThe Journal of Chemical Physics|November 6, 2007
Calculation of vibrational frequencies through a variational reduced-coupling approachYohann Scribano, David M BenoitThe Journal of Chemical Physics|August 14, 2009
Fast degenerate correlation-corrected vibrational self-consistent field calculations of the vibrational spectrum of 4-mercaptopyridineInga Respondek, David M BenoitThe Journal of Chemical Physics|December 11, 2013
A fragment method for systematic improvement of anharmonic adsorbate vibrational frequencies: acetylene on Cu(001)Sergey K Chulkov, David M BenoitFaraday Discussions|September 22, 2018
Does cage quantum delocalisation influence the translation-rotational bound states of molecular hydrogen in clathrate hydrate?David M Benoit, David Lauvergnat, Yohann ScribanoThe Journal of Chemical Physics|September 14, 2010
Fast vibrational configuration interaction using generalized curvilinear coordinates and self-consistent basisYohann Scribano, David M Lauvergnat, David M BenoitJournal of Chemical Theory and Computation|March 23, 2018
Influence of Solvent Representation on Nuclear Shielding Calculations of Protonation States of Small Biological MoleculesChristina C Roggatz, Mark Lorch, David M BenoitPhysical Chemistry Chemical Physics : PCCP|May 8, 2010
Bis(terpyridine)-based surface template structures on graphite: a force field and DFT studyDaniela Künzel, Thomas Markert, Axel Gross, et al.Peerj. Computer Science|August 15, 2024
Encoder-decoder convolutional neural network for simple CT segmentation of COVID-19 infected lungsKiri S Newson, David M Benoit, Andrew W BeavisPageof 4