Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
Advancing Density Functional Tight-Binding method for Large Organic Molecules through Equivariant Neural Networks
, Authors:
Leonardo Rafael Medrano Sandonas, Mirela Puleva, Ricardo Parra Payano, Martin Stöhr, Gianaurelio Cuniberti, Alexandre Tkatchenko
Version 1 posted 24 April 2025
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