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5 results in Authors: Yeongsu Cho

Materials Science

Improving Gas Adsorption Modeling for MOFs by Local Calibration of Hubbard U Parameters

Yeongsu Cho, Heather Kulik

Version 1 posted 02 February 2024

247

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Theoretical and Computational Chemistry

Gas-Phase and Solid-State Electronic Structure Analysis and DFT Benchmarking of HfCO

Isuru Ariyarathna, Yeongsu Cho, Chenru Duan, Heather Kulik

Version 1 posted 15 September 2023

128

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Materials Chemistry

DFT-based Multireference Diagnostics in the Solid State: Focusing on Metal-organic Frameworks

Yeongsu Cho, Aditya Nandy, Chenru Duan, Heather Kulik

Version 1 posted 29 August 2022

430

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Scientific Machine Learning of 2D Perovskite Nanosheet Formation

Jakob C Dahl, Samuel Niblett, Yeongsu Cho, Xingzhi Wang, Ye Zhang, Emory Chan, A. Paul Alivisatos

Version 1 posted 07 June 2023

270

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Theoretical and Computational Chemistry

Assessing UFF and DFT-tuned Force Fields for Predicting Experimental Isotherms of MOFs

Yeongsu Cho, Jakob Teetz, Heather Kulik

Version 1 posted 04 November 2024

271

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