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Inorganic Chemistry

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Theoretical and Computational Chemistry

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Enrique Batista

3 results in Authors: Enrique Batista

Theoretical and Computational Chemistry

On the importance of configuration search to the predictivity of lanthanide selectivity

Thomas Summers, Michael Taylor, Logan Augustine, Jan Janssen, Danny Perez, Enrique Batista, Ping Yang

Version 1 posted 19 August 2024

312

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1

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Inorganic Chemistry

Design, Isolation, and Spectroscopic Analysis of a Tetravalent Terbium Complex

Natalie Rice, Ivan Popov, Dominic Russo, John Bacsa, Enrique Batista, Ping Yang, Joshua Telser, Henry La Pierre

Version 1 posted 24 June 2019

747

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Theoretical and Computational Chemistry

MLTB: Enhancing Transferability and Extensibility of Density Functional Tight Binding Theory with Multi-body Interaction Corrections

Daniel Burrill, Chang Liu, Michael Taylor, Marc Cawkwell, Nicholas Lubbers, Danny Perez, Enrique Batista, Ping Yang

Version 1 posted 11 July 2024

241

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1

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