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The Journal of Chemical Physics|November 4, 2011
Dispersion, static correlation, and delocalisation errors in density functional theory: an electrostatic theorem perspectiveAustin D Dwyer, David J TozerJournal of Chemical Theory and Computation|January 3, 2022
Incorporation of the Fermi-Amaldi Term into Direct Energy Kohn-Sham CalculationsDaisy J Dillon, David J TozerThe Journal of Chemical Physics|January 6, 2006
Semiempirical hybrid functional with improved performance in an extensive chemical assessmentThomas W Keal, David J TozerThe Journal of Chemical Physics|July 28, 2007
Modeling temporary anions in density functional theory: calculation of the Fukui functionDavid J Tozer, Frank De ProftPhysical Chemistry Chemical Physics : PCCP|September 28, 2005
Exchange methods in Kohn-Sham theoryAndrew M Teale, David J TozerPhysical Chemistry Chemical Physics : PCCP|March 14, 2009
Analyzing Kullback-Leibler information profiles: an indication of their chemical relevanceAlex Borgoo, Pablo Jaque, Alejandro Toro-Labbé, et al.Journal of Chemical Theory and Computation|November 28, 2015
Dependence of Excited State Potential Energy Surfaces on the Spatial Overlap of the Kohn-Sham Orbitals and the Amount of Nonlocal Hartree-Fock Exchange in Time-Dependent Density Functional TheoryJürgen Plötner, David J Tozer, Andreas DreuwPhysical Chemistry Chemical Physics : PCCP|July 1, 2015
The importance of current contributions to shielding constants in density-functional theorySarah Reimann, Ulf Ekström, Stella Stopkowicz, et al.The Journal of Physical Chemistry. A|September 14, 2012
Overcoming low orbital overlap and triplet instability problems in TDDFTMichael J G Peach, David J TozerJournal of Chemical Theory and Computation|December 3, 2015
Rotational g Tensors Calculated Using Hybrid Exchange-Correlation Functionals with the Optimized Effective Potential ApproachAndrew M Teale, Trygve Helgaker, David J TozerPageof 7