UNT Theses and Dissertations - 20 Matching Results

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Primary view of Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach
Wilson, Brent R.
August 2011
Primary view of Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods
Laury, Marie L.
August 2013
Primary view of Accurate Energetics Across the Periodic Table Via Quantum Chemistry
Peterson, Charles Campbell
December 2015
Primary view of Advancements in Instrumentation for Fourier Transform Microwave Spectroscopy
Dewberry, Christopher Thomas
August 2011
Primary view of Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions
Riojas, Amanda G.
May 2015
Primary view of Computational Modeling of Small Molecules
Weber, Rebecca J.
December 2015
Primary view of Computational Studies on Group 14 Elements (C, Si and Ge) in Organometallic and Biological Compounds.
Yu, Liwen
May 2007
Primary view of The evaluation, development, and application of the correlation consistent basis sets.
Yockel, Scott
December 2006
Primary view of From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets
Gibson, Joshua S.
May 2014
Primary view of The Impact of Computational Methods on Transition Metal-containing Species
Wang, Jiaqi
December 2015
Primary view of Kinetics and Mechanisms of Ligand Exchange Reactions of Chelate Complexes
Cortés, José E. (José Enrique)
May 1989
Primary view of Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach
Borders, Tammie L.
May 2012
Primary view of The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties
Oyedepo, Gbenga A.
December 2011
Primary view of The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations
Mahler, Andrew
May 2016
Primary view of Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation
Determan, John J.
August 2011
Primary view of Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules
South, Christopher James
August 2016
Primary view of Quantum Perspectives on Physical and Inorganic Chemistry
Grimes-Marchan, Thomas V.
December 2007
Primary view of Systematic Approaches to Predictive Computational Chemistry using the Correlation Consistent Basis Sets
Prascher, Brian P.
May 2009
Primary view of Thermochemistry Investigations Via the Correlation Consistent Composite Approach
Jorgensen, Kameron R.
December 2012
Primary view of Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation
Liu, Cong
August 2013
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