Journal of the American Chemical Society

An Automated Workflow to Discover the Structure–Stability Relations for Radiation Hard Molecular Semiconductors

A Andreas J. Bornschlegl (Faculty of Engineering, Department of Material Science) P Patrick Duchstein (Chair for Theoretical Chemistry/Computer Chemistry Center (CCC), Department of Chemistry and Pharmacy, Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Nägelsbachstraße 25, 91052 Erlangen, Germany) J Jianchang Wu (Forschungszentrum Jülich GmbH) J Juan S. Rocha-Ortiz (Institute of Materials for Electronics and Energy Technology (i-MEET), Department of Materials Science and Engineering, Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Martensstraße 7, 91058 Erlangen, Germany) M Mauricio Caicedo-Reina (Heterocyclic Compounds Research Group, Department of Chemistry, Universidad del Valle, Calle 13 #100-00, 25360 Cali, Colombia) A Alejandro Ortiz (Heterocyclic Compounds Research Group, Department of Chemistry, Universidad del Valle, Calle 13 #100-00, 25360 Cali, Colombia) B Braulio Insuasty (Heterocyclic Compounds Research Group, Department of Chemistry, Universidad del Valle, Calle 13 #100-00, 25360 Cali, Colombia) D Dirk Zahn (Computer Chemistry Center (CCC) & Interdisciplinary Center for Molecular Materials (ICMM), Friedrich-Alexander-Universität Erlangen-Nürnberg, Nägelsbachstraße 25, 91052 Erlangen, Germany) L Larry Lüer C Christoph J. Brabec (Institute of Energy Materials and Devices - Photovoltaics (IMD-3))
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Article Details

Volume / Issue Vol. 147, Issue 2
Published January 15, 2025
Pages 1957-1967
ISSN 0002-7863
Publisher American Chemical Society

Journal Info

Journal of the American Chemical Society

American Chemical Society
ISSN: 0002-7863 Physical Sciences

Authors (10)

A

Andreas J. Bornschlegl

Faculty of Engineering, Department of Material Science

P

Patrick Duchstein

Chair for Theoretical Chemistry/Computer Chemistry Center (CCC), Department of Chemistry and Pharmacy, Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Nägelsbachstraße 25, 91052 Erlangen, Germany

J

Jianchang Wu

Forschungszentrum Jülich GmbH

J

Juan S. Rocha-Ortiz

Institute of Materials for Electronics and Energy Technology (i-MEET), Department of Materials Science and Engineering, Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Martensstraße 7, 91058 Erlangen, Germany

M

Mauricio Caicedo-Reina

Heterocyclic Compounds Research Group, Department of Chemistry, Universidad del Valle, Calle 13 #100-00, 25360 Cali, Colombia

A

Alejandro Ortiz

Heterocyclic Compounds Research Group, Department of Chemistry, Universidad del Valle, Calle 13 #100-00, 25360 Cali, Colombia

B

Braulio Insuasty

Heterocyclic Compounds Research Group, Department of Chemistry, Universidad del Valle, Calle 13 #100-00, 25360 Cali, Colombia

D

Dirk Zahn

Computer Chemistry Center (CCC) & Interdisciplinary Center for Molecular Materials (ICMM), Friedrich-Alexander-Universität Erlangen-Nürnberg, Nägelsbachstraße 25, 91052 Erlangen, Germany

L

Larry Lüer

C

Christoph J. Brabec

Institute of Energy Materials and Devices - Photovoltaics (IMD-3)

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