Accurate, Affordable, and Generalisable Machine Learning Simulations of Transition Metal X-ray Absorption Spectra using the XANESNET Deep Neural Network

Name: Accurate, Affordable, and Generalisable Machine Learning Simulations of Transition Metal X-ray Absorption Spectra using the XANESNET Deep Neural Network
Published: 2022-02-02T10:51:22+00:00
License: https://creativecommons.org/licenses/by/4.0/
Keywords: X-ray spectroscopy, Deep Neural Networks, Transition metals, Computational Chemistry