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Journal of Chemical Information and Modeling
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April 5, 2023
<i>WhereWulff</i>: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions
Rohan Yuri Sanspeur, Javier Heras-Domingo, John R Kitchin, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
July 1, 2025
Spin-informed universal graph neural networks for simulating magnetic ordering
Wenbin Xu, Rohan Yuri Sanspeur, Adeesh Kolluru, et al.
Journal of the American Chemical Society
|
October 1, 2025
How Electrolyte pH Affects the Oxygen Reduction Reaction
Jay T Bender, Rohan Yuri Sanspeur, Nicolas Bueno Ponce, et al.
Journal of the American Chemical Society
|
June 3, 2024
Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution
Jehad Abed, Javier Heras-Domingo, Rohan Yuri Sanspeur, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
Journal of Chemical Information and Modeling
|
April 5, 2023
<i>WhereWulff</i>: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions
Rohan Yuri Sanspeur, Javier Heras-Domingo, John R Kitchin, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
July 1, 2025
Spin-informed universal graph neural networks for simulating magnetic ordering
Wenbin Xu, Rohan Yuri Sanspeur, Adeesh Kolluru, et al.
Journal of the American Chemical Society
|
October 1, 2025
How Electrolyte pH Affects the Oxygen Reduction Reaction
Jay T Bender, Rohan Yuri Sanspeur, Nicolas Bueno Ponce, et al.
Journal of the American Chemical Society
|
June 3, 2024
Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution
Jehad Abed, Javier Heras-Domingo, Rohan Yuri Sanspeur, et al.
Page
of 1