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  Electron and chemical reservoir corrections for point-defect formation energies

Freysoldt, C., Lange, B., Neugebauer, J., Yan, Q., Lyons, J. L., Janotti, A., et al. (2016). Electron and chemical reservoir corrections for point-defect formation energies. Physical Review B, 93(16): 165206. doi:10.1103/physrevb.93.165206.

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Item Permalink: http://hdl.handle.net/11858/00-001M-0000-002A-D807-0 Version Permalink: http://hdl.handle.net/11858/00-001M-0000-002E-2A2E-F
Genre: Journal Article

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 Creators:
Freysoldt, Christoph1, Author              
Lange, Björn1, Author              
Neugebauer, Jörg2, Author              
Yan, Qimin3, Author              
Lyons, John L.4, Author              
Janotti, Anderson5, Author              
Van de Walle, Chris G.6, 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              
3Molecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA, ou_persistent22              
4Center for Functional Nanomaterials, Brookhaven National Laboratory, Upton, New York 11973, USA, ou_persistent22              
5Department of Materials Science and Engineering, University of Delaware, Newark, Delaware 19716-3106, USA, ou_persistent22              
6Materials Department, University of California, Santa Barbara, CA 93106-5050, USA, ou_persistent22              

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Language(s): eng - English
 Dates: 2016-01-192016-04-142016-04-22
 Publication Status: Published in print
 Pages: -
 Publishing info: -
 Table of Contents: -
 Rev. Method: Peer
 Identifiers: DOI: 10.1103/physrevb.93.165206
 Degree: -

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Title: Physical Review B
  Abbreviation : Phys. Rev. B
Source Genre: Journal
 Creator(s):
Affiliations:
Publ. Info: Woodbury, NY : American Physical Society
Pages: - Volume / Issue: 93 (16) Sequence Number: 165206 Start / End Page: - Identifier: ISSN: 1098-0121
CoNE: /journals/resource/954925225008