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Metal-Organic Framework Glasses with Permanent Accessible Porosity

Chao Zhou, Louis Longley, Andraz Krajnc, Glen J. Smales, Ang Qiao, Ilknur Erucar, Cara M. Doherty, Aaron W. Thornton, Anita J. Hill, Christopher W. Ashling, Omid T. Qazvini, Seok June Lee, Philip A. Chater, Nicholas J. Terrill, Andrew J. Smith, Yuanzheng Yue, Gregor Mali, David A. Keen, Shane G. Telfer, Thomas D. Bennett

Version 1 posted 29 June 2018

767

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Polymer Science

Working Paper

Photocatalytically Active Ladder Polymers

Anastasia Vogel, Mark forster, Liam Wilbraham, Charlotte Smith, Alexander Cowan, Martijn Zwijnenburg, Seb Sprick, Andrew I. Cooper

Version 1 posted 26 November 2018

608

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Materials Chemistry

Working Paper

Mixed Hierarchical Local Structure in a Disordered Metal–Organic Framework

Adam Sapnik, Irene Bechis, Sean M. Collins, Duncan Johnstone, Giorgio Divitini, Andrew J Smith, Philip A. Chater, Mathew Addicoat, Tim Johnson, David A. Keen, Kim Jelfs, Thomas Bennett

Version 1 posted 18 December 2020

418

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Energy

Working Paper

Quantification of Inactive Lithium and Solid Electrolyte Interphase (SEI) Species on Graphite Electrodes After Fast Charging

Eric McShane, Andrew Colclasure, David Brown, Zachary M. Konz, Kandler Smith, Bryan D. McCloskey

Version 1 posted 23 April 2020

1,034

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Discovering a Transferable Charge Assignment Model Using Machine Learning

Andrew E. Sifain, Nicholas Lubbers, Benjamin T. Nebgen, Justin S. Smith, Andrey Y. Lokhov, Olexandr Isayev, Adrian E. Roitberg, Kipton Barros, Sergei Tretiak

Version 1 posted 22 June 2018

1,416

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Theoretical and Computational Chemistry

Working Paper

Psi4 1.4: Open-Source Software for High-Throughput Quantum Chemistry

Daniel Smith, Lori Burns, Andrew Simmonett, Robert Parrish, Matthew Schieber, Raimondas Galvelis, Peter Kraus, Holger Kruse, Roberto Di Remigio, Asem Alenaizan, Andrew James, Susi Lehtola, Jonathon Misiewicz, Maximilian Scheurer, Robert Shaw, Jeffrey Schriber, Yi Xie, Zachary Glick, Dominic Sirianni, Joseph O'Brien, Jonathan Waldrop, Ashutosh Kumar, Edward G. Hohenstein, Benjamin Pritchard, Bernard Brooks, Henry Schaefer, Alexander Sokolov, Konrad Patkowski, Eugene DePrince, Ugur Bozkaya, Rollin King, Francesco Evangelista, Justin Turney, Thomas Crawford, David Sherrill

Version 1 posted 05 March 2020

1,666

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3

Citations

Organic Chemistry

Working Paper

Radical–Anion Coupling Through Reagent Design: Hydroxylation of Aryl Halides

Andrew J. Greener, Patrycja Ubysz, Will Owens-Ward, George Smith, Adrian C. Whitwood, Michael J. James

Version 1 posted 12 August 2021

743

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Organic Chemistry

Working Paper

Benzophenone as a Cheap and Effective Photosensitizer for the Photocatalytic Synthesis of Dimethyl Cubane-1,4-dicarboxylate

Callum Prentice, Alice Martin, James Morrison, Andrew Smith, Eli Zysman-Colman

Version 1 posted 17 January 2023

560

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Physical Chemistry

Working Paper

Predicting Phosphorescence Energies and Inferring Wavefunction Localization with Machine Learning

Andrew E. Sifain, Levi Lystrom, Richard A. Messerly, Justin Smith, Benjamin Nebgen, Kipton Barros, Sergei Tretiak, Nicholas Lubbers, Brendan J. Gifford

Version 3 posted 30 June 2021

673

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Physical Chemistry

Working Paper

Fingerprinting Redox Heterogeneity in Electrodes during Extreme Fast Charging

Aashutosh Mistry, Francois L. E. Usseglio-Viretta, Andrew Colclasure, Kandler Smith, Partha P. Mukherjee

Version 1 posted 11 December 2019

566

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1

Citations

Refine Search

36 results in Andrew Smith in Authors: Andrew Smith

Metal-Organic Framework Glasses with Permanent Accessible Porosity

Photocatalytically Active Ladder Polymers

Mixed Hierarchical Local Structure in a Disordered Metal–Organic Framework

Quantification of Inactive Lithium and Solid Electrolyte Interphase (SEI) Species on Graphite Electrodes After Fast Charging

Discovering a Transferable Charge Assignment Model Using Machine Learning

Psi4 1.4: Open-Source Software for High-Throughput Quantum Chemistry

Radical–Anion Coupling Through Reagent Design: Hydroxylation of Aryl Halides

Benzophenone as a Cheap and Effective Photosensitizer for the Photocatalytic Synthesis of Dimethyl Cubane-1,4-dicarboxylate

Predicting Phosphorescence Energies and Inferring Wavefunction Localization with Machine Learning

Fingerprinting Redox Heterogeneity in Electrodes during Extreme Fast Charging

36 results in Authors: Andrew Smith