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Journal article

Cover Picture: Autonomous Discovery of Materials for Intercalation Electrodes (Batteries & Supercaps 6/2020)

From

Department of Energy Conversion and Storage, Technical University of Denmark1

Atomic Scale Materials Modelling, Department of Energy Conversion and Storage, Technical University of Denmark2

Technical University of Denmark3

The Front Cover illustrates an autonomous workflow, implemented in the framework of Density Functional Theory, designed to automatically calculate crucial properties for battery intercalation electrodes, including thermodynamic and mechanical stability, open circuit voltages (OCV), as well as kinetic barriers.

Applied here to identify cathode materials for Mg‐ion batteries, this workflow enables an accelerated discovery of intercalation battery electrodes. More information can be found in the Article by J. M. Garcia‐Lastra, I. E. Castelli and co‐workers.

Language: English
Year: 2020
Pages: 470-470
ISSN: 25666223
Types: Journal article
DOI: 10.1002/batt.202000102
ORCIDs: Vegge, Tejs , García Lastra, Juan Maria , Castelli, Ivano Eligio and 0000-0002-6421-1486

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