结构化学
  ISSN 0254-5861  CN35-1112/TQ  
 
结构化学  2019, Vol. 38 Issue (4): 509-532    
  theoretical chemistry 本期目录 | 过刊浏览 | 高级检索 |
C-,N-和S-掺杂BiOCl的电子和光学吸收性质:密度泛函理论研究
姚文志;姚建斌;张霞;马亚豪
a (Department of Environmental and Municipal Engineering, North China University of Water Resources and Electric Power, Zhengzhou 450011, China)
b (Institute for Computational Materials Science, School of Physics and Electronics, Henan University, Kaifeng 475004, China)
c (Department of Information Engineering, North China University of Water Resources and Electric Power, Zhengzhou 450011, China)
Electronic Structure and Optical-absorption Properties of C-, N-, and S-doped BiOCl: the First-principles Calculations
YAO Wen-Zhi;YAO Jian-Bin;ZHANG Xia;MA Ya-Hao
a (Department of Environmental and Municipal Engineering, North China University of Water Resources and Electric Power, Zhengzhou 450011, China)
b (Institute for Computational Materials Science, School of Physics and Electronics, Henan University, Kaifeng 475004, China)
c (Department of Information Engineering, North China University of Water Resources and Electric Power, Zhengzhou 450011, China)
 
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