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Inorganic Chemistry

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Theoretical and Computational Chemistry

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Working Paper

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Sara E. Mason

4 results in Authors: Sara E. Mason

Theoretical and Computational Chemistry

First-Principles and Thermodynamics Comparison of Compositionally-Tuned Delafossites: Cation Release from the (001) Surface of Complex Metal Oxides

Joseph W. Bennett, Diamond Jones, Blake G. Hudson, Joshua Melendez-Rivera, Robert Hamers, Sara E. Mason

Version 1 posted 05 November 2019

480

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1

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Inorganic Chemistry

Formation of the [Ge4O16Al48(OH)108(H2O)24]20+ Tetramer from Condensation of ε-GeAl12 Keggin Polycations

Mohammad Shohel, Jennifer Bjorklund, Jack Smith, Sara E. Mason, Tori Z. Forbes

Version 1 posted 03 September 2020

283

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Theoretical and Computational Chemistry

First-Principles Characterization and Comparison of Clean, Hydrated, and Defect α-Al2O3 (110) Surfaces

ali abbaspour tamijani, Jennifer Bjorklund, Jeffrey Catalano, Sara E. Mason

Version 1 posted 29 November 2019

514

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Theoretical and Computational Chemistry

DFT and Thermodynamics Calculations of Surface Cation Release in LiCoO2

ali abbaspour tamijani, Joseph W. Bennett, Diamond T. Jones, Natalia Cartagena-Gonzalez, Zachary R. Jones, Elizabeth D. Laudadio, Robert Hamers, Juan A. Santana, Sara E. Mason

Version 1 posted 06 September 2019

989

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3

Citations