Large-Scale Computational Screening of Molecular Organic Semiconductors Using Crystal Structure Prediction

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Authors: Jack Yang, Sandip De, Josh E. Campbell, Sean Li, Michele Ceriotti, Graeme M. Day

Journal title: Chemistry of Materials

Journal number: 30/13

Journal publisher: American Chemical Society

Published year: 2018

Published pages: 4361-4371

DOI identifier: 10.1021/acs.chemmater.8b01621

ISSN: 0897-4756