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Theoretical and Computational Chemistry

Working Paper

Lithium Ion Conduction in Cathode Coating Materials from On-the-Fly Machine Learning

Chuhong Wang, Koutarou Aoyagi, Pandu Wisesa, Tim Mueller

Version 1 posted 15 November 2019

1,079

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Theoretical and Computational Chemistry

Working Paper

Ionic Conduction Through Reaction Products at the Electrolyte/electrode Interface in All-Solid-State Li⁺ Batteries

Chuhong Wang, Koutarou Aoyagi, Muratahan Aykol, Tim Mueller

Version 1 posted 25 September 2020

1,093

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Theoretical and Computational Chemistry

Working Paper

Catalytic Activity Maps for Alloy Nanoparticles

Liang Cao, Tim Mueller

Version 3 posted 24 February 2023

557

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Energy

Working Paper

Computational Design of Double-Layer Cathode Coatings in All-Solid-State Batteries

Chuhong Wang, Koutarou Aoyagi, Tim Mueller

Version 2 posted 29 September 2021

1,044

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Catalysis

Working Paper

Computationally Generated Maps of Surface Structures and Catalytic Activities for Alloy Phase Diagrams

Liang Cao, Le, Niu, Tim Mueller

Version 3 posted 13 September 2019

1,405

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Inorganic Chemistry

Working Paper

Ordered Intermetallic Nanoparticles with High Catalytic Activity Prepared by an Electrochemically Induced Phase Transformation

Du Sun, yunfei wang, Kenneth Livi, chuhong wang, ruichun luo, zhuoqun zhang, hamdan alghamdi, chenyang li, fufei an, bernard gaskey, Tim Mueller, Shoji Hall

Version 1 posted 19 June 2019

654

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Materials Science

Working Paper

Nature of the amorphous-amorphous interfaces in solid-state batteries revealed using machine-learned interatomic potentials

Chuhong Wang, Muratahan Aykol, Tim Mueller

Version 2 posted 17 July 2023

527

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1

Citations

Nanoscience

Working Paper

Accelerated Prediction of Atomically Precise Cluster Structures Using On-the-fly Machine Learning

Yunzhe Wang, Shanping Liu, Peter Lile, Sam Norwood, Alberto Hernandez, Sukriti Manna, Tim Mueller

Version 1 posted 20 August 2021

535

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Materials Chemistry

Working Paper

A Database of Low-Energy Atomically Precise Nanoclusters

Sukriti Manna, Alberto Hernandez, Yunzhe Wang, Peter Lile, Shanping Liu, Tim Mueller

Version 1 posted 01 December 2021

1,614

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4

Citations

Materials Chemistry

Working Paper

An Electrochemical Series for Materials

Tim Mueller, Joseph Montoya, Weike Ye, Xiangyun Lei, Linda Hung, Jens Hummelshøj, Michael Puzon, Daniel Martinez, Chris Fajardo, Rachel Abela

Version 3 posted 11 March 2024

424

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Refine Search

11 results in Tim Mueller in Authors: Tim Mueller

Lithium Ion Conduction in Cathode Coating Materials from On-the-Fly Machine Learning

Ionic Conduction Through Reaction Products at the Electrolyte/electrode Interface in All-Solid-State Li⁺ Batteries

Catalytic Activity Maps for Alloy Nanoparticles

Computational Design of Double-Layer Cathode Coatings in All-Solid-State Batteries

Computationally Generated Maps of Surface Structures and Catalytic Activities for Alloy Phase Diagrams

Ordered Intermetallic Nanoparticles with High Catalytic Activity Prepared by an Electrochemically Induced Phase Transformation

Nature of the amorphous-amorphous interfaces in solid-state batteries revealed using machine-learned interatomic potentials

Accelerated Prediction of Atomically Precise Cluster Structures Using On-the-fly Machine Learning

A Database of Low-Energy Atomically Precise Nanoclusters

An Electrochemical Series for Materials

11 results in Authors: Tim Mueller