Methods in Computational Thermodynamics and Kinetics
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This topic is no longer accepting submissions.
Manuscript Submission Deadline:
December 01, 2024
Publication Date: June 2025
Keywords: Computational Materials Science & Engineering, Education, ICME, Modeling and Simulation, Physical Properties
Scope: Computational thermodynamics and kinetics methods generate insight into the fundamental behavior of materials across many scales and are relevant in computational design and discovery of materials. By publishing peer-reviewed tutorial articles, this topic will increase the visibility of these methods and provide a starting point and some working knowledge to those interested in using them. Tutorials have an educational focus, provide an overview of core principles, and include sufficient details to reproduce all results. Submissions related to the stability, synthesis, properties, or discovery of materials that use computational, data-centric, or high-throughput methods, including integration with experiments, are encouraged.
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