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  Anharmonicity in bcc refractory elements: A detailed ab initio analysis

Srinivasan, P., Shapeev, A., Neugebauer, J., Körmann, F., & Grabowski, B. (2023). Anharmonicity in bcc refractory elements: A detailed ab initio analysis. Physical Review B, 107(1): 014301. doi:10.1103/PhysRevB.107.014301.

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Item Permalink: https://hdl.handle.net/21.11116/0000-000C-840A-4 Version Permalink: https://hdl.handle.net/21.11116/0000-000F-AA9C-2
Genre: Journal Article

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 Creators:
Srinivasan, Prashanth1, 2, Author           
Shapeev, Alexander3, Author           
Neugebauer, Jörg4, Author           
Körmann, Fritz5, 6, Author           
Grabowski, Blazej7, Author           
Affiliations:
1Department of Materials Science and Engineering, Delft University of Technology, Mekelweg 2, Delft, 2628 CD, The Netherlands, ou_persistent22              
2Institute of Materials Science, University of Stuttgart, Pfaffenwaldring 55, D-70569 Stuttgart, Germany, ou_persistent22              
3Skolkovo Institute of Science and Technology, Skolkovo Innovation Center, Nobel St. 3, Moscow, 143026, Russian Federation, ou_persistent22              
4Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863337              
5Department of Materials Science and Engineering, Delft University of Technology, Mekelweg 2, 2628 CD Delft, The Netherlands, ou_persistent22              
6Complex Concentrated Alloys, Project Groups, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_3291775              
7Institute of Materials Science, University of Stuttgart, Pfaffenwaldring 55, Stuttgart, 70569, Germany, ou_persistent22              

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Language(s): eng - English
 Dates: 2022-12-062023-01-04
 Publication Status: Issued
 Pages: -
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1103/PhysRevB.107.014301
 Degree: -

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Project name : Our project on rare-earth-based alloys for hard-magnetic applications: temperature and pressure-dependent phase stabilities (RE-MAP) is supported by Deutsche Forschungsgemeinschaft (DFG Project No. 316912154). The partial finance by Bosch-Forschungsstiftung for this work is acknowledged.
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Title: Physical Review B
  Abbreviation : Phys. Rev. B
Source Genre: Journal
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Publ. Info: Woodbury, NY : American Physical Society
Pages: - Volume / Issue: 107 (1) Sequence Number: 014301 Start / End Page: - Identifier: ISSN: 1098-0121
CoNE: https://pure.mpg.de/cone/journals/resource/954925225008