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6 results in Authors: Zhenpeng Yao

Materials Science

From computational screening to the synthesis of a promising OER catalyst

Sai Govind Hari Kumar, Carlota Bozal-Ginesta, Ning Wang, Jehad Abed, Chung Hsuan Shan, Zhenpeng Yao, Alan Aspuru-Guzik

Version 2 posted 06 June 2024

679

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Frank-van der Merwe Growth in Bilayer Graphene

Haozhe Wang, Zhenpeng Yao, Gang Seob Jung, Qichen Song, Marek Hempel, Tomas Palacios, Gang Chen, Markus J. Buehler, Alan Aspuru-Guzik, Jing Kong

Version 2 posted 11 August 2021

1,459

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Theoretical and Computational Chemistry

Inverse Design of Nanoporous Crystalline Reticular Materials with Deep Generative Models

Zhenpeng Yao, Benjamin Sanchez-Lengeling, N. Scott Bobbitt, Benjamin J. Bucior, Sai Govind Hari Kumar, Sean P. Collins, Thomas Burns, Tom K. Woo, Omar Farha, Randall Q. Snurr, Alan Aspuru-Guzik

Version 2 posted 25 August 2020

5,751

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Theoretical and Computational Chemistry

Machine Learning the Quantum-Chemical Properties of Metal–Organic Frameworks for Accelerated Materials Discovery with a New Electronic Structure Database

Andrew Rosen, Shaelyn Iyer, Debmalya Ray, Zhenpeng Yao, Alan Aspuru-Guzik, Laura Gagliardi, Justin Notestein, Randall Q. Snurr

Version 1 posted 29 October 2020

2,382

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5

Citations

Fast and Extensive Intercalation Chemistry in Wadsley-Roth Phase Based High-Capacity Electrodes

Miao Wang, Zhenpeng Yao, Qianqian Li, Yongfeng Hu, Jing Zhang, Jiujun Zhang, Yufeng Zhao, Alan Aspuru-Guzik

Version 1 posted 23 April 2020

1,094

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Discovery of Calcium-Metal Alloy Anodes for Reversible Ca-Ion Batteries

Zhenpeng Yao, Vinay I. Hegde, Alan Aspuru-Guzik, Christopher Wolverton

Version 1 posted 29 October 2018

1,478

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