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Journal of Chemical Theory and Computation|April 8, 2020
Transport and Spectroscopy in Conjugated Molecules: Two Properties and a Single RationaleFrancisco F Ramirez, Carlos M Bustamente, Mariano C González Lebrero, et al.
Journal of Materials Chemistry. A|May 10, 2024
A bridge between trust and control: computational workflows meet automated battery cyclingPeter Kraus, Edan Bainglass, Francisco F Ramirez, et al.
Scientific Data|September 9, 2020
AiiDA 1.0, a scalable computational infrastructure for automated reproducible workflows and data provenanceSebastiaan P Huber, Spyros Zoupanos, Martin Uhrin, et al.
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