Handbook of Materials Modeling
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Beschreibung
The Handbook of Materials Modeling, 2nd edition is a six-volume major reference serving a steadily growing community at the intersection of two mainstreams of global research: computational science and materials science and technology. This extensively expanded new edition reflects the significant developments in all aspects of computational materials research over the past decade, featuring progress in simulations at multiple scales and increasingly more realistic materials models. Thematically separated into two mutually dependent sets – “Methods: Theory and Modeling (MTM)” and “Applications: Current and Emerging Materials (ACE)” – the handbook runs the entire gamut from theory and methods to simulations and applications. Readers benefit from its in-depth coverage of a broad methodological spectrum extending from advanced atomistic simulations of rare events to data-driven artificial intelligence strategies for materials informatics in the set MTM, as well as forefront emphasis on materials of far-ranging societal importance such as photovoltaics and energy-relevant oxides, and cutting-edge applications to materials for spintronic devices, graphene, cement, and glasses in the set ACE. The thorough, interconnected coverage of methods and applications, together with a line-up of internationally acclaimed editors and authors, will ensure the Handbook of Material Modeling’s standing as an enduring source of learning and inspiration for a global community of computational materials scientists.
The long-awaited updated edition of a classic reference work on materials modeling and simulation across length and time scales
Presents a definitive collection of articles on electronic-structure and atomistic methods for graduate students
Serves as authoritative handbook spanning the vast extent of materials modeling methods and their applications to real materials
Enriched with the topical interest areas that foresee applications of multiscale modeling in interdisciplinary settings
Includes supplementary material: sn.pub/extras
The long-awaited updated edition of a classic reference work on materials modeling and simulation across length and time scales
Presents a definitive collection of articles on electronic-structure and atomistic methods for graduate students
Serves as authoritative handbook spanning the vast extent of materials modeling methods and their applications to real materials
Enriched with the topical interest areas that foresee applications of multiscale modeling in interdisciplinary settings
Title is also available as part of a set: Handbook of Materials Modeling (978-3-319-78876-0)
Autor*in
Wanda Andreoni
Themen in »Handbook of Materials Modeling«
Quantum Mechanics/ Molecular Mechanics (QM/MM) Time-Dependent Density Functional Theory (TDDFT) Multiscale materials modeling Coarse-grained models Atomistic simulations Microstructure evolution