Materials Informatics : Methods, Tools, and Applications Hardback
Edited by Olexandr Isayev, Alexander Tropsha, Stefano Curtarolo
Provides everything readers need to know for applying the power of informatics to materials science There is a tremendous interest in materials informatics and application of data mining to materials science.
This book is a one-stop guide to the latest advances in these emerging fields.
Bridging the gap between materials science and informatics, it introduces readers to up-to-date data mining and machine learning methods.
It also provides an overview of state-of-the-art software and tools.
Case studies illustrate the power of materials informatics in guiding the experimental discovery of new materials. Materials Informatics: Methods, Tools and Applications is presented in two parts?Methodological Aspects of Materials Informatics and Practical Aspects and Applications.
The first part focuses on developments in software, databases, and high-throughput computational activities.
Chapter topics include open quantum materials databases; the ICSD database; open crystallography databases; and more.
The second addresses the latest developments in data mining and machine learning for materials science.
Its chapters cover genetic algorithms and crystal structure prediction; MQSPR modeling in materials informatics; prediction of materials properties; amongst others. -Bridges the gap between materials science and informatics -Covers all the known methodologies and applications of materials informatics -Presents case studies that illustrate the power of materials informatics in guiding the experimental quest for new materials -Examines the state-of-the-art software and tools being used today Materials Informatics: Methods, Tools and Applications is a must-have resource for materials scientists, chemists, and engineers interested in the methods of materials informatics.
- Format: Hardback
- Pages: 304 pages
- Publisher: Wiley-VCH Verlag GmbH
- Publication Date: 09/10/2019
- Category: Materials science
- ISBN: 9783527341214