Explorer.py: Mapping the energy landscapes of complex materials

The energy landscape of a material holds information that describes the thermodynamics and the kinetics of any process, making it valuable to understand a range of important phenomena. Mapping energy landscapes is a difficult task, with multiple approaches offering different ways to explore the land...

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Bibliographic Details
Main Authors: Collin J. Wilkinson, John C. Mauro
Format: Article
Language:English
Published: Elsevier 2021-06-01
Series:SoftwareX
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2352711021000285