Fully ab initio finite-size corrections for charged defect supercell 
calculations

Freysoldt, Christoph; Neugebauer, Jörg; Van de Walle, Chris G.

doi:10.1103/PhysRevLett.102.016402

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Fully ab initio finite-size corrections for charged defect supercell calculations

Freysoldt, C., Neugebauer, J., & Van de Walle, C. G. (2009). Fully ab initio finite-size corrections for charged defect supercell calculations. Physical Review Letters, 102(1): 016402. doi:10.1103/PhysRevLett.102.016402.

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Item Permalink: https://hdl.handle.net/11858/00-001M-0000-0019-42BA-9 Version Permalink: https://hdl.handle.net/11858/00-001M-0000-002E-232F-9

Genre: Journal Article

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Creators:
Freysoldt, Christoph¹, Author
Neugebauer, Jörg², Author
Van de Walle, Chris G.², Author

Affiliations:
1Defect Chemistry and Spectroscopy, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863342
2Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863337

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Language(s): eng - English

Dates: Date issued: 2009-01-05

Publication Status: Issued

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Rev. Type: Peer

Identifiers: eDoc: 378147
DOI: 10.1103/PhysRevLett.102.016402

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Title: Physical Review Letters

Abbreviation : Phys. Rev. Lett.

Source Genre: Journal

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Publ. Info: Woodbury, N.Y. : American Physical Society

Pages: 4 Volume / Issue: 102 (1) Sequence Number: 016402 Start / End Page: - Identifier: ISSN: 0031-9007
CoNE: https://pure.mpg.de/cone/journals/resource/954925433406_1