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Browsing by Author Ayers, Paul W.

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Showing results 1 to 15 of 15

Publication Date	Title	Author(s)
Nov-2017	Accurate Calculations of Nonlinear Optical Properties Using Finite Field Methods	Mohammed, Ahmed A. K.
2019	Comparative Study of Population Analysis Methods With Quasi Atomic-Orbitals	Dikmenli, Kumru
Oct-2011	Computational approaches to predicting and characterising chemical and biochemical processes	Liu, Yuli
Oct-2013	COMPUTATIONAL APPROACHES TO PROTONATION AND DEPROTONATION REACTIONS FOR BIOLOGICAL MACROMOLECULES AND SUPRAMOLECULAR COMPLEXES	mohammed, ahmed
Apr-2012	Computing the Kinetic Energy from Electron Distribution Functions	Chakraborty, Debajit
2019	Conformer Searching	Garner, Jennifer H.
May-2008	Efficient Grid-Based Techniques for Density Functional Theory.	Rodriguez-Hernandez, Juan I.
2024	Excited state methods for strongly-correlated systems: formulations based on the equation-of-motion approach	Sanchez-Diaz, Gabriela
Nov-2010	From wavefunctions to chemical reactions	Anderson, James
Oct-2012	The Mixed State of a $\pi$-Striped Superconductor	Zelli, Mirsaeed
Jun-2015	Model Wavefunction Forms to Describe Strong Correlation in Quantum Chemistry	Johnson, Paul Andrew
2021	New Strategies for Kinetic Energy Density Functionals	Huang, Xiaomin
2014	New Transition-State Optimization Methods By Carefully Selecting Appropriate Internal Coordinates	Rabi, Sandra
2018	Systematic improvement of approximations with smooth models of the Coulomb potential	Gonzalez Espinoza, Cristina Elizabeth
Oct-2012	Weighted Density Approximations for Kohn-Sham Density Functional Theory	Cuevas-Saavedra, Rogelio

Showing results 1 to 15 of 15

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