Liberal Arts Research Commons

Importance and Reliability of Small Basis Set CCSD(T) Corrections to MP2 Binding and Relative Energies of Water Clusters, Berhane Temelso, Carla Renner, George Shields
Berhane Temelso

Computational estimation of pKa values, Paul Seybold, George Shields
Berhane Temelso

The Role of Anharmonicity in Hydrogen-Bonded Systems: The Case of Water Clusters, Berhane Temelso, George Shields
Berhane Temelso

Quantum Mechanical Study of Sulfuric Acid Hydration: Atmospheric Implications, Berhane Temelso, Thomas Morrell, Robert Shields, Marco Allodi, Elena Wood, Karl Kirschner, Thomas Castonguay, Kaye Archer, George Shields
Berhane Temelso

Structures of Cage, Prism, and Book Isomers of Water Hexamer from Broadband Rotational Spectroscopy, Cristóbal Pérez, Matt Muckle, Daniel Zaleski, Nathan Seifert, Berhane Temelso, George Shields, Zbigniew Kisiel, Brooks Pate
Berhane Temelso

Hydration of the Bisulfate Ion: Atmospheric Implications, Devon Husar, Berhane Temelso, Alexa Ashworth, George Shields
Berhane Temelso

Structural Analysis of alpha-Fetoprotein (AFP)-like Peptides with Anti-Breast-Cancer Properties, Berhane Temelso, Katherine Alser, Arianne Gauthier, Amber Palmer, George Shields
Berhane Temelso