Area of research
Atomic and Molecular Physics, and Optics · Atmospheric Science
Research interest
Research interests include Advanced Chemical Physics Studies, Inorganic Fluorides and Related Compounds, Atmospheric Ozone and Climate, and Chemical Thermodynamics and Molecular Structure.
Energetic and Electronic Properties of UX<sup>+/0/–</sup> for X = Li and Be and Comparison of the Properties of the Uranium Atom Binding to 2nd Row Elements Li–F
Energetic and Electronic Properties of UO<sup>0/±</sup> and UF<sup>0/±</sup>
Anion Photoelectron Spectroscopy and Ab Initio Studies of the UF<sup>–</sup> Anion
Bond Energies of UO<sup>+</sup> and UC<sup>+</sup>: Guided Ion Beam and Quantum Chemical Studies of the Reactions of Uranium Cation with O<sub>2</sub> and CO
Theoretical and Experimental Study of the Spectroscopy and Thermochemistry of UC<sup>+/0/–</sup>
Electronic Properties of UN and UN<sup>–</sup> from Photoelectron Spectroscopy and Correlated Molecular Orbital Theory
Interaction of Th with H<sup>0/–/+</sup>: Combined Experimental and Theoretical Thermodynamic Properties
Bond Dissociation Energies in Heavy Element Chalcogen and Halogen Small Molecules
Guided Ion Beam and Quantum Chemical Investigation of the Thermochemistry of Thorium Dioxide Cations: Thermodynamic Evidence for Participation of f Orbitals in Bonding
A Computational Assessment of Actinide Dioxide Cations AnO<sub>2</sub><sup>2+</sup>for An = U to Lr: The Limited Stability Range of the Hexavalent Actinyl Moiety, [O═An═O]<sup>2+</sup>
Polarizabilities of neutral atoms and atomic ions with a noble gas electron configuration
Calculated Ionization Potentials of MO<sub>3</sub> and MO<sub>2</sub> for M = U, Mo, W, and Nd
Bond energy of ThN+: A guided ion beam and quantum chemical investigation of the reactions of thorium cation with N2 and NO
Potential Energy Surface of Group 11 Trimers (Cu, Ag, Au): Bond Angle Isomerism in Au<sub>3</sub>
Electronic Structure Predictions of the Energetic Properties of Tellurium Fluorides
Activation of Water by Pentavalent Actinide Dioxide Cations: Characteristic Curium Revealed by a Reactivity Turn after Americium
Gas Phase Hydrolysis and Oxo‐Exchange of Actinide Dioxide Cations: Elucidating Intrinsic Chemistry from Protactinium to Einsteinium
Computational Study of Molecular Hydrogen Adsorption over Small (MO<sub>2</sub>)<sub><i>n</i></sub> Nanoclusters (M = Ti, Zr, Hf; <i>n</i> = 1 to 4)
Prediction of Bond Dissociation Energies/Heats of Formation for Diatomic Transition Metal Compounds: CCSD(T) Works
Structures and Heats of Formation of Simple Alkaline Earth Metal Compounds II: Fluorides, Chlorides, Oxides, and Hydroxides for Ba, Sr, and Ra
Remarkably High Stability of Late Actinide Dioxide Cations: Extending Chemistry to Pentavalent Berkelium and Californium
Characterization of Carbenes via Hydrogenation Energies, Stability, and Reactivity: What's in a Name?
Acidity of M(VI)O<sub>2</sub>(OH)<sub>2</sub> for M = Group 6, 16, and U as Central Atoms
Benchmark-Quality Atomization Energies for BeH and BeH<sub>2</sub>
Bond energies of ThO+ and ThC+: A guided ion beam and quantum chemical investigation of the reactions of thorium cation with O2 and CO
Use of Improved Orbitals for CCSD(T) Calculations for Predicting Heats of Formation of Group IV and Group VI Metal Oxide Monomers and Dimers and UCl<sub>6</sub>
The Impact of Larger Basis Sets and Explicitly Correlated Coupled Cluster Theory on the Feller–Peterson–Dixon Composite Method
Structures and Properties of the Products of the Reaction of Lanthanide Atoms with H<sub>2</sub>O: Dominance of the +II Oxidation State
Reliable Potential Energy Surfaces for the Reactions of H<sub>2</sub>O with ThO<sub>2</sub>, PaO<sub>2</sub><sup>+</sup>, UO<sub>2</sub><sup>2+</sup>, and UO<sub>2</sub><sup>+</sup>
Gas Phase Properties of MX<sub>2</sub> and MX<sub>4</sub> (X = F, Cl) for M = Group 4, Group 14, Cerium, and Thorium