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Materials Informatics : Methods, Tools, and Applications
Title
Materials Informatics : Methods, Tools, and Applications / edited by Olexandr Isayev, Alexander Tropsha, Stefano Curtarolo.
ISBN
3527802258
9783527802265
3527802266
9783527802258
9783527341214
Published
Weinheim, Germany : Wiley-VCH, 2019.
Physical Description
1 online resource (306 pages)
Local Notes
Access is available to the Yale community.
Access and use
Access restricted by licensing agreement.
Variant and related titles
Knovel. OCLC KB.
Other formats
Print version: Isayev, Olexandr. Materials Informatics : Methods, Tools, and Applications. Newark : John Wiley & Sons, Incorporated, ©2019
Format
Books / Online
Language
English
Added to Catalog
February 04, 2021
Bibliography
Includes bibliographical references and index.
Contents
Crystallography Open Database: History, Development, and Perspectives / Saulius Gražulis, Andrius Merkys, Antanas Vaitkus, Daniel Chateigner, Luca Lutterotti, Peter Moeck, Miguel Quiros, Robert T Downs, Werner Kaminsky, Armel Le Bail
The Inorganic Crystal Structure Database (ICSD): A Tool for Materials Sciences / Stephan Rühl
Pauling File: Toward a Holistic View / Pierre Villars, Karin Cenzual, Roman Gladyshevskii, Shuichi Iwata
From Topological Descriptors to Expert Systems: A Route to Predictable Materials / Alexander P Shevchenko, Eugeny V Alexandrov, Olga A Blatova, Denis E Yablokov, Vladislav A Blatov
A High-Throughput Computational Study Driven by the AiiDA Materials Informatics Framework and the PAULING FILE as Reference Database / Martin Uhrin, Giovanni Pizzi, Nicolas Mounet, Nicola Marzari, Pierre Villars
Modeling Materials Quantum Properties with Machine Learning / Felix A Faber, O Anatole von Lilienfeld
Automated Computation of Materials Properties / Cormac Toher, Corey Oses, Stefano Curtarolo
Cognitive Chemistry: The Marriage of Machine Learning and Chemistry to Accelerate Materials Discovery / Edward O Pyzer-Knapp
Machine Learning Interatomic Potentials for Global Optimization and Molecular Dynamics Simulation / Ivan A Kruglov, Pavel E Dolgirev, Artem R Oganov, Arslan B Mazitov, Sergey N Pozdnyakov, Efim A Mazhnik, Alexey V Yanilkin.
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