Record link: 
http://hdl.handle.net/20.500.12708/139306
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Title: 
Chemical trends in the high thermoelectric performance of the pyrite-type dichalcogenides ZnS₂, CdS₂, and CdSe₂
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Citation: 
Jia, T., Carrete, J., Madsen, G. K. H., Zhang, Y., & Wei, S. (2022). Chemical trends in the high thermoelectric performance of the pyrite-type dichalcogenides ZnS₂, CdS₂, and CdSe₂. Physical Review B, 105(24), Article 245203. https://doi.org/10.1103/PhysRevB.105.245203
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Publisher DOI: 
10.1103/PhysRevB.105.245203
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Publication Type: 
Article - Original Research Article
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Language: 
English
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Authors: 
Jia, Tiantian 
Carrete, Jesús 
Madsen, Georg Kent Hellerup 
Zhang, Yongsheng 
Wei, Suhuai 
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Organisational Unit: 
E165-03-1 - Forschungsgruppe Theoretische Materialchemie 
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Journal: 
Physical Review B 
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ISSN: 
2469-9950
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Date (published): 
15-Jun-2022
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Publisher: 
AMER PHYSICAL SOC
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Peer reviewed: 
Yes
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Keywords: 
Electronic structure; First-principles calculations; thermal conductivity
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Research Areas: 
Quantum Modeling and Simulation: 20%
Materials Characterization: 40%
Computational Materials Science: 40%
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Science Branch: 
1040 - Chemie: 100%
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