Synthesis, Characterization, and Density Functional Theory Investigation of the Solid-State [UO(2)Cl(4)(H(2)O)](2–) Complex

por Rajapaksha, Harindu, Mason, Sara E., Forbes, Tori Z.
Publicado 2023

Three-Dimensional Noncovalent Interaction Network within [NpO(2)Cl(4)](2–) Coordination Compounds: Influence on Thermochemical and Vibrational Properties

por Rajapaksha, Harindu, Benthin, Grant C., Kravchuk, Dmytro V., Lightfoot, Haley, Mason, Sara E., Forbes, Tori Z.
Publicado 2023

Periodic Density Functional Theory Calculations of Uranyl Tetrachloride Compounds Engaged in Uranyl–Cation and Uranyl–Hydrogen Interactions: Electronic Structure, Vibrational, and...

por Augustine, Logan J., Rajapaksha, Harindu, Pyrch, Mikaela Mary F., Kasperski, Maguire, Forbes, Tori Z., Mason, Sara E.
Publicado 2022

Investigations of the Cobalt Hexamine Uranyl Carbonate System: Understanding the Influence of Charge and Hydrogen Bonding on the Modification of Vibrational Modes in Uranyl Compoun...

por Pyrch, Mikaela Mary F., Bjorklund, Jennifer L., Williams, James M., Kasperski, Maguire, Mason, Sara E., Forbes, Tori Z.
Publicado 2022

DFT Computed Dielectric Response and THz Spectra of Organic Co-Crystals and Their Constituent Components

por Bennett, Joseph W., Raglione, Michaella E., Oburn, Shalisa M., MacGillivray, Leonard R., Arnold, Mark A., Mason, Sara E.
Publicado 2019