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Density functional theory: a practical introduction, 2nd edition
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Density functional theory: a practical introduction, 2nd edition Density functional theory: a practical introduction, 2nd edition , by David S. Sholl and Janice A. Steckel, Hoboken, NJ, Wiley, 2023, 204 pp., £91.25 (hardcover), ISBN 978-1119840862. Scope: textbook. Level: graduate student, researcher
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Ab Initio Molecular Dynamics
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Single-atom alloys for sustainability-related electrocatalytic applications
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A Theoretical Perspective for Ammonia Synthesis: Nitric Oxide or Nitrate Electroreduction?
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