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Journal of Chemical Theory and Computation|September 7, 2022
Topological Analysis of Functions on Arbitrary Grids: Applications to Quantum ChemistryMichael J Hutcheon, Andrew M TealeThe Journal of Chemical Physics|March 3, 2005
Ground- and excited-state diatomic bond lengths, vibrational levels, and potential-energy curves from conventional and localized Hartree-Fock-based density-functional theoryAndrew M Teale, David J TozerPhysical Chemistry Chemical Physics : PCCP|September 28, 2005
Exchange methods in Kohn-Sham theoryAndrew M Teale, David J TozerThe Journal of Chemical Physics|January 28, 2012
Effective homogeneity of the exchange-correlation and non-interacting kinetic energy functionals under density scalingAlex Borgoo, Andrew M Teale, David J TozerPhysical Chemistry Chemical Physics : PCCP|April 9, 2014
Revisiting the density scaling of the non-interacting kinetic energyAlex Borgoo, Andrew M Teale, 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 TozerJournal of Chemical Theory and Computation|July 11, 2017
Efficient Calculation of Molecular Integrals over London Atomic OrbitalsTom J P Irons, Jan Zemen, Andrew M TealeThe Journal of Chemical Physics|August 7, 2008
Orbital energies and negative electron affinities from density functional theory: Insight from the integer discontinuityAndrew M Teale, Frank De Proft, David J TozerJournal of Chemical Theory and Computation|March 16, 2021
Modeling Ultrafast Electron Dynamics in Strong Magnetic Fields Using Real-Time Time-Dependent Electronic Structure MethodsMeilani Wibowo, Tom J P Irons, Andrew M TealeThe Journal of Chemical Physics|March 3, 2007
Transition metal NMR chemical shifts from optimized effective potentialsAndrew M Teale, Aron J Cohen, David J TozerPageof 5