Category:
Materials Chemistry
,
Working Paper
, Title:
CoeffNet: Predicting activation barriers through a chemically-interpretable, equivariant and physically constrained graph neural network
, Authors:
Sudarshan Vijay, Maxwell Venetos, Evan Spotte-Smith, Aaron Kaplan, Mingjian Wen, Kristin Persson
Version 1 posted 21 August 2023
385
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