Tuning the Magnetic Exchange via a Control of Orbital Hybridization in
Abstract
Here, we report the complex magnetic phase diagram and electronic structure of Cr2 ( Te1-xWx) O6 systems. While compounds with different x values possess the same crystal structure, they display different magnetic structures below and above xc = 0.7 , where both the transition temperature TN and sublattice magnetization (Ms) reach a minimum. Unlike many known cases where magnetic interactions are controlled either by injection of charge carriers or by structural distortion induced via chemical doping, in the present case it is achieved by tuning the orbital hybridization between Cr 3d and O 2p orbitals through W 5d states. The result is supported by ab initio electronic structure calculations. Through this concept, we introduce a new approach to tune magnetic and electronic properties via chemical doping.
- Authors:
- Publication Date:
- Research Org.:
- Energy Frontier Research Centers (EFRC) (United States). Revolutionary Materials for Solid State Energy Conversion (RMSSEC)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1370354
- DOE Contract Number:
- SC0001054
- Resource Type:
- Journal Article
- Journal Name:
- Physical Review Letters
- Additional Journal Information:
- Journal Volume: 113; Journal Issue: 7; Related Information: RMSSEC partners with Michigan State University (lead); University of California, Los Angeles; University of Michigan; Northwestern University; Oak Ridge National Laboratory; Ohio State University; Wayne State University; Journal ID: ISSN 0031-9007
- Publisher:
- American Physical Society (APS)
- Country of Publication:
- United States
- Language:
- English
Citation Formats
Zhu, M., Do, D., Dela Cruz, C. R., Dun, Z., Zhou, H. D., Mahanti, S. D., and Ke, X. Tuning the Magnetic Exchange via a Control of Orbital Hybridization in Cr2(Te1-xWx)O6. United States: N. p., 2014.
Web. doi:10.1103/PhysRevLett.113.076406.
Zhu, M., Do, D., Dela Cruz, C. R., Dun, Z., Zhou, H. D., Mahanti, S. D., & Ke, X. Tuning the Magnetic Exchange via a Control of Orbital Hybridization in Cr2(Te1-xWx)O6. United States. https://doi.org/10.1103/PhysRevLett.113.076406
Zhu, M., Do, D., Dela Cruz, C. R., Dun, Z., Zhou, H. D., Mahanti, S. D., and Ke, X. 2014.
"Tuning the Magnetic Exchange via a Control of Orbital Hybridization in Cr2(Te1-xWx)O6". United States. https://doi.org/10.1103/PhysRevLett.113.076406.
@article{osti_1370354,
title = {Tuning the Magnetic Exchange via a Control of Orbital Hybridization in Cr2(Te1-xWx)O6},
author = {Zhu, M. and Do, D. and Dela Cruz, C. R. and Dun, Z. and Zhou, H. D. and Mahanti, S. D. and Ke, X.},
abstractNote = {Here, we report the complex magnetic phase diagram and electronic structure of Cr2 ( Te1-xWx) O6 systems. While compounds with different x values possess the same crystal structure, they display different magnetic structures below and above xc = 0.7 , where both the transition temperature TN and sublattice magnetization (Ms) reach a minimum. Unlike many known cases where magnetic interactions are controlled either by injection of charge carriers or by structural distortion induced via chemical doping, in the present case it is achieved by tuning the orbital hybridization between Cr 3d and O 2p orbitals through W 5d states. The result is supported by ab initio electronic structure calculations. Through this concept, we introduce a new approach to tune magnetic and electronic properties via chemical doping.},
doi = {10.1103/PhysRevLett.113.076406},
url = {https://www.osti.gov/biblio/1370354},
journal = {Physical Review Letters},
issn = {0031-9007},
number = 7,
volume = 113,
place = {United States},
year = {2014},
month = {8}
}
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