Ferromagnetic origin of Na and Mn codoped CaZn2As2 diluted magnetic semiconductor: A first-principles study
- Authors: Hua L.1, Zhu J.N.1, Lu Z.T.1
- 
							Affiliations: 
							- Nanjing Normal University Taizhou College
 
- Issue: Vol 103, No 10 (2016)
- Pages: 631-635
- Section: Condensed Matter
- URL: https://journals.rcsi.science/0021-3640/article/view/159360
- DOI: https://doi.org/10.1134/S0021364016100076
- ID: 159360
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Abstract
We have investigated the electronic structure and magnetic properties of Na and Mn codoped CaZn2As2 using density functional theory within the generalized gradient approximation (GGA)+U schemes. We have shown that the ground state magnetic structure of Mn-doped CaZn2As2 is antiferromagnetic while holemediated Zener’s p–d exchange is responsible for the origin of ferromagnetism of Na and Mn codoped CaZn2As2.
About the authors
L. Hua
Nanjing Normal University Taizhou College
							Author for correspondence.
							Email: pjsd@163.com
				                					                																			                												                	China, 							Taizhou, 225300						
J. N. Zhu
Nanjing Normal University Taizhou College
														Email: pjsd@163.com
				                					                																			                												                	China, 							Taizhou, 225300						
Z. T. Lu
Nanjing Normal University Taizhou College
														Email: pjsd@163.com
				                					                																			                												                	China, 							Taizhou, 225300						
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