Published March 30, 2015
| Version v1
Journal article
Electronic structure and magnetism in g-C4N3 controlled by strain engineering
Creators
- 1. Key Laboratory of Modern Acoustics, MOE, Institute of Acoustics, Collaborative Innovation Center of Advanced Microstructures, National Laboratory of Solid State Microstructures, Nanjing University, Nanjing 210093 (China)
- 2. Department of Physics, NingBo University, NingBo 315001 (China)
- 3. Department of Physics and Materials Science, City University of Hong Kong, Tat Chee Avenue, Kowloon, Hong Kong (China)
Description
Regulation of magnetism and half-metallicity has attracted much attention because of its potential in spintronics. The magnetic properties and electronic structure of graphitic carbon nitride (g-C4N3) with external strain are determined theoretically based on the density function theory and many-body perturbation theory (G0W0). Asymmetric deformation induced by uniaxial strain not only regulates the magnetic characteristics but also leads to a transformation from half-metallicity to metallicity. However, this transition cannot occur in the structure with symmetric deformation induced by biaxial strain. Our results suggest the use of strain engineering in metal-free spintronics applications
Additional details
Identifiers
- DOI
- 10.1063/1.4916814;
Publishing Information
- Journal Title
- Applied Physics Letters
- Journal Volume
- 106
- Journal Issue
- 13
- Journal Page Range
- p. 132406-132406.4
- ISSN
- 0003-6951
- CODEN
- APPLAB
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 46104519
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- ASYMMETRY; CARBON NITRIDES; DEFORMATION; DENSITY FUNCTIONAL METHOD; ELECTRONIC STRUCTURE; GRAPHITE; MAGNETIC PROPERTIES; MAGNETISM; MANY-BODY PROBLEM; METALLICITY; PERTURBATION THEORY; PHASE TRANSFORMATIONS; POTENTIALS; STRAINS; SYMMETRY
- Descriptors DEC
- CALCULATION METHODS; CARBON; CARBON COMPOUNDS; ELEMENTS; MINERALS; NITRIDES; NITROGEN COMPOUNDS; NONMETALS; PHYSICAL PROPERTIES; PNICTIDES; VARIATIONAL METHODS
Optional Information
- Notes
- (c) 2015 AIP Publishing LLC