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Kareesa Kron

5 results in Authors: Kareesa Kron

Theoretical and Computational Chemistry

Consistent Inclusion of Continuum Solvation in Energy Decomposition Analysis: Theory and Application to Molecular CO2 Reduction Catalysts

Yuezhi Mao, Matthias Loipersberger, Kareesa Kron, Jeffrey Derrick, Christopher Chang, Shaama Mallikarjun Sharada, Martin Head-Gordon

Version 1 posted 08 October 2020

338

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Modeling and characterization of exciplexes in photoredox CO2 reduction: Insights from quantum chemistry and fluorescence spectroscopy

Kareesa Kron, Jonathan Ryan Hunt, Jahan Dawlaty, Shaama Mallikarjun Sharada

Version 1 posted 20 December 2021

263

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1

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Computational Analysis of Electron Transfer Kinetics for CO2 Reduction with Organic Photoredox Catalysts

Kareesa Kron, Samantha Gomez, Robert Cave, Shaama Mallikarjun Sharada

Version 1 posted 05 March 2020

548

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Theoretical and Computational Chemistry

Towards Efficient Direct Dynamics Studies of Chemical Reactions: A Novel Matrix Completion Algorithm

Stephen Jon Quiton, Jeongmin Chae, Selin Bac, Kareesa Kron, Urbashi Mitra, Shaama Mallikarjun Sharada

Version 1 posted 04 April 2022

201

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1

Citations

Theoretical and Computational Chemistry

A matrix completion algorithm for efficient calculation of quantum and variational effects in chemical reactions

Selin Bac, Stephen Jon Quiton, Kareesa J. Kron, Jeongmin Chae, Urbashi Mitra, Shaama Mallikarjun Sharada

Version 2 posted 22 March 2022

321

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