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6 results in Authors: William West

Theoretical and Computational Chemistry

Reaction Mechanism Generator v3.0: Advances in Automatic Mechanism Generation

Mengjie Liu, Alon Grinberg Dana, Matthew Johnson, Mark Goldman, Agnes Jocher, A. Mark Payne, Colin Grambow, Kehang Han, Nathan Wa-Wai Yee, Emily Mazeau, Katrin Blondal, Richard West, Franklin Goldsmith, William H. Green

Version 1 posted 29 December 2020

1,486

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Room Temperature Electrochemical Fluoride (De)Insertion into the Defect Pyrochlore CsMnFeF6

Jessica Andrews, Eric McClure, Kenneth Jew, Molleigh Preefer, Ahamed Irshad, Matthew Lertola, Daniel Robertson, Charlene Salamat, Michael Brady, Louis Piper, Sarah Tolbert, Johanna Nelson Weker, Brad Chmelka, Bruce Dunn, Sri Narayan, William West, Brent Melot

Version 1 posted 11 April 2022

351

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Automatic Generation of Chemical Mechanisms for Electrochemical Systems: Solid Electrolyte Interphase Formation in Lithium Batteries

Matthew Johnson, David Farina Jr., Lance Kavalsky, Judit Zador, Richard West, Venkatasubramanian Viswanathan, William Green

Version 1 posted 16 July 2024

225

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Analytical Chemistry

Electrochemical Imaging of Thermochemical Catalysis

Xiangdong Xu, William Howland, Daniel Martín-Yerga, Cole Cadaram, Deiaa Harraz, Geoff West, Patrick Unwin, Yogesh Surendranath

Version 1 posted 30 July 2024

537

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Physical Chemistry

The RMG Database for Chemical Property Prediction

Matthew S. Johnson, Xiaorui Dong, Alon Grinberg Dana, Yunsie Chung, David Farina, Ryan J. Gillis, Mengjie Liu, Nathan W. Yee, Katrin Blondal, Emily Mazeau, Colin Grambow, A. Mark Payne, Kevin Spiekermann, Hao-Wei Pang, C. Franklin Goldsmith, Richard H. West, William H. Green

Version 1 posted 22 July 2022

961

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1

Citations

Physical Chemistry

Automated Reaction Kinetics and Network Exploration (Arkane): A Statistical Mechanics, Thermodynamics, Transition State Theory, and Master Equation Software

Alon Grinberg Dana, Matthew Johnson, Joshua Allen, Sandeep Sharma, Sumathy Raman, Mengjie Liu, Connie Gao, Colin Grambow, Mark Goldman, Duminda Ranasinghe, Ryan Gillis, Allen Mark Payne, Yi-Pei Li, Enoch Dames, Zachary Buras, Nick Vandewiele, Nathan Yee, Shamel Merchant, Beat Buesser, Caleb Class, Franklin Goldsmith, Richard West, William Green

Version 1 posted 22 July 2022

1,039

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5

Citations