scholarly journals Ferromagnetism of C doped ZnO: first-principles calculation and Monte Carlo simulation

2009 ◽  
Vol 58 (3) ◽  
pp. 2011
Author(s):  
Chen Shan ◽  
Wu Qing-Yun ◽  
Chen Zhi-Gao ◽  
Xu Gui-Gui ◽  
Huang Zhi-Gao
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
First Principles ◽  
First Principles Calculation ◽  
Doped Zno

Time-Fluctuation of the Dimer Structure on a Ge(001) Surface Studied by a Monte Carlo Simulation and a First-Principles Calculation

2002 ◽  
Vol 71 (9) ◽  
pp. 2192-2199 ◽  
Author(s):  
Hiroshi Kawai ◽  
Yoshihide Yoshimoto ◽  
Hiromitsu Shima ◽  
Yoshimichi Nakamura ◽  
Masaru Tsukada
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
First Principles ◽  
First Principles Calculation ◽  
Dimer Structure ◽  
Time Fluctuation

Ge(001) surface reconstruction studied using a first-principles calculation and a Monte Carlo simulation

2000 ◽  
Vol 61 (3) ◽  
pp. 1965-1970 ◽  
Author(s):  
Yoshihide Yoshimoto ◽  
Yoshimichi Nakamura ◽  
Hiroshi Kawai ◽  
Masaru Tsukada ◽  
Masatoshi Nakayama
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Surface Reconstruction ◽  
First Principles ◽  
First Principles Calculation

First-principles calculation of (Al,Ga) co-doped ZnO

2019 ◽  
Vol 21 ◽  
pp. e00426 ◽  
Author(s):  
M. Khuili ◽  
G. El Hallani ◽  
N. Fazouan ◽  
H. Abou El Makarim ◽  
E.H. Atmani
Keyword(s):  
First Principles ◽  
First Principles Calculation ◽  
Doped Zno ◽  
Co Doped

First-Principles Calculation of Electronic Structure and Optical Properties of Sb-Doped ZnO

2008 ◽  
Vol 25 (10) ◽  
pp. 3735-3738 ◽  
Author(s):  
Zhang Fu-Chun ◽  
Zhang Zhi-Yong ◽  
Zhang Wei-Hu ◽  
Yan Jun-Feng ◽  
Yun Jiang-Ni
Keyword(s):  
Optical Properties ◽  
Electronic Structure ◽  
First Principles ◽  
First Principles Calculation ◽  
Doped Zno

scholarly journals Monte Carlo simulation on the indirect exchange interactions of Co-doped ZnO film

2002 ◽  
Vol 81 (12) ◽  
pp. 2217-2219 ◽  
Author(s):  
Abraham F. Jalbout ◽  
Hanning Chen ◽  
Scott L. Whittenburg
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Exchange Interactions ◽  
Zno Film ◽  
Indirect Exchange ◽  
Doped Zno ◽  
Co Doped

Ferromagnetism properties of Er-doped ZnO: a GGA + U study

RSC Advances ◽  
2016 ◽  
Vol 6 (109) ◽  
pp. 107865-107870 ◽  
Author(s):  
Sanjun Wang ◽  
Xiaobo Shi ◽  
Jinming Li
Keyword(s):  
Magnetic Moment ◽  
First Principles ◽  
Room Temperature ◽  
Room Temperature Ferromagnetism ◽  
First Principles Calculation ◽  
Doped Zno ◽  
Er Doped ◽  
Zn Vacancy

Our first-principles calculation finds that only the Zn vacancy can induce a 1.0 μB magnetic moment in Er-doped ZnO, which comes from the unpaired 2p electrons at the ligand O atom and results in the room-temperature ferromagnetism property of ZnO.

scholarly journals Photoelectric properties of Ti doped ZnO: First principles calculation

2016 ◽  
Vol 65 (15) ◽  
pp. 157201
Author(s):  
Qu Ling-Feng ◽  
Hou Qing-Yu ◽  
Xu Zhen-Chao ◽  
Zhao Chun-Wang
Keyword(s):  
First Principles ◽  
First Principles Calculation ◽  
Photoelectric Properties ◽  
Doped Zno

Magnetic properties of Mn doped ZnO: A Monte Carlo simulation analysis

Vacuum ◽  
2021 ◽  
Vol 183 ◽  
pp. 109786
Author(s):  
A. Bandyopadhyay ◽  
N. Gupta ◽  
M. Nath ◽  
S. Chakraborty ◽  
S. Sutradhar
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Magnetic Properties ◽  
Simulation Analysis ◽  
Doped Zno ◽  
Mn Doped
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