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  Benchmark Data Set of Crystalline Organic Semiconductors

Zhugayevych, A., Sun, W., van der Heide, T., Lien-Medrano, C. R., Frauenheim, T., & Tretiak, S. (2023). Benchmark Data Set of Crystalline Organic Semiconductors. Journal of Chemical Theory and Computation, 19(22), 8481-8490. doi:10.1021/acs.jctc.3c00861.

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Item Permalink: https://hdl.handle.net/21.11116/0000-000E-13A5-2 Version Permalink: https://hdl.handle.net/21.11116/0000-000E-13A6-1
Genre: Journal Article

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2023-12-JCTC-Zhugayevych-et-al-Benchmark-data-set-of-crystalline-organic-semiconductors.pdf (Publisher version), 2MB
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2023
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 Creators:
Zhugayevych, Andriy1, Author           
Sun, Wenbo, Author
van der Heide, Tammo, Author
Lien-Medrano, Carlos R., Author
Frauenheim, Thomas, Author
Tretiak, Sergei, Author
Affiliations:
1Dept. Kremer: Polymer Theory, MPI for Polymer Research, Max Planck Society, ou_1800287              

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Language(s): eng - English
 Dates: 2023-11-162023-11-29
 Publication Status: Issued
 Pages: -
 Publishing info: -
 Table of Contents: -
 Rev. Type: -
 Identifiers: DOI: 10.1021/acs.jctc.3c00861
 Degree: -

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Title: Journal of Chemical Theory and Computation
  Other : JCTC
  Abbreviation : J. Chem. Theory Comput.
Source Genre: Journal
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Publ. Info: Washington, D.C. : American Chemical Society
Pages: - Volume / Issue: 19 (22) Sequence Number: - Start / End Page: 8481 - 8490 Identifier: ISSN: 1549-9618
CoNE: https://pure.mpg.de/cone/journals/resource/111088195283832