Akksay Singh
3PUBLICATIONS
6CO-AUTHORS
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Publications (3)
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|Nov 19, 2024
Automatic Feature Selection for Atom-Centered Neural Network Potentials Using a Gradient Boosting Decision Algorithm.Renzhe Li, Jiaqi Wang, Akksay Singh
|Nov 12, 2024
Uncertainty Based Machine Learning-DFT Hybrid Framework for Accelerating Geometry Optimization.Akksay Singh, Jiaqi Wang, Graeme Henkelman
|Feb 21, 2024
Local-environment-guided selection of atomic structures for the development of machine-learning potentials.Renzhe Li, Chuan Zhou, Akksay Singh
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