Advances in Density-Functional Calculations for Materials Modeling

Maurer, Reinhard J.; Freysoldt, Christoph; Reilly, Anthony M.; Brandenburg, Jan Gerit; Hofmann, Oliver T.; Björkman, Torbjörn; Lebègue, Sébastien; Tkatchenko, Alexandre

doi:10.1146/annurev-matsci-070218-010143

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Advances in Density-Functional Calculations for Materials Modeling

Maurer, R. J., Freysoldt, C., Reilly, A. M., Brandenburg, J. G., Hofmann, O. T., Björkman, T., et al. (2019). Advances in Density-Functional Calculations for Materials Modeling. Annual Review of Materials Research, 49, 1-30. doi:10.1146/annurev-matsci-070218-010143.

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Item Permalink: https://hdl.handle.net/21.11116/0000-0004-76D7-5 Version Permalink: https://hdl.handle.net/21.11116/0000-0004-76D9-3

Genre: Journal Article

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Creators:
Maurer, Reinhard J.¹, Author
Freysoldt, Christoph², Author
Reilly, Anthony M.³, Author
Brandenburg, Jan Gerit^{4, 5}, Author
Hofmann, Oliver T.⁶, Author
Björkman, Torbjörn⁷, Author
Lebègue, Sébastien⁸, Author
Tkatchenko, Alexandre⁹, Author

Affiliations:
1Department of Chemistry, University of Warwick, Coventry CV4 7AL, UK, ou_persistent22
2Defect Chemistry and Spectroscopy, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863342
3School of Chemical Sciences, Dublin City University, Glasnevin, Dublin 9, Ireland, ou_persistent22
4Institute for Physical Chemistry, University of Göttingen, 37077 Göttingen, Germany, ou_persistent22
5Interdisciplinary Center for Scientific Computing, University of Heidelberg, 69120 Heidelberg, Germany, ou_persistent22
6Institute of Solid State Physics, Graz University of Technology, ou_persistent22
7Physics, Faculty of Science and Engineering, Åbo Akademi, FI-20500 Turku, Finland, ou_persistent22
8Laboratoire de Physique et Chimie Théoriques, CNRS UMR 7019, Institut Jean Barriol, Université de Lorraine, BP 239, 54506 Vandoeuvre-lès-Nancy, France, ou_persistent22
9Physics and Materials Science Research Unit, University of Luxembourg, ou_persistent22

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Language(s): eng - English

Dates: Published Online: 2019-02-22Date issued: 2019

Publication Status: Issued

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Identifiers: DOI: 10.1146/annurev-matsci-070218-010143

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Title: Annual Review of Materials Research

Other : Ann. Rev. Mater. Res.

Source Genre: Journal

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Publ. Info: Palo Alto, Calif. : Annual Reviews

Pages: - Volume / Issue: 49 Sequence Number: - Start / End Page: 1 - 30 Identifier: ISSN: 1531-7331
CoNE: https://pure.mpg.de/cone/journals/resource/954925460108