ABX

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Electronegativity explanation on the efficiency-enhancing mechanism of the hybrid inorganic–organic perovskite ABX_3 from first-principles study
《Chinese Physics B》2016年第2期393-398,共6页陈清源 黄杨 黄鹏儒 马泰 曹超 何垚 
Project supported by the National Natural Science Foundation of China(Grant Nos.61366007,11164032,and 61066005);the Program for New Century Excellent Talents in University of Ministry of Education of China(Grant No.NCET-12-1080);the Basic Applied Research Foundation of Yunnan Province,China(Grant Nos.2011CI003 and 2013FB007);the Excellent Young Talents in Yunnan University,China
Organic–inorganic hybrid perovskites play an important role in improving the efficiency of solid-state dye-sensitized solar cells. In this paper, we systematically explore the efficiency-enhancing mechanism of ABX_3...
关键词:ABX3 efficiency-enhancing mechanism of ABX3 optical and electronic properties hybrid per-ovskite solar cells 
Nature of the band gap of halide perovskites ABX_3(A=CH_3NH_3,Cs;B=Sn,Pb;X=Cl,Br,I):First-principles calculations被引量:4
《Chinese Physics B》2015年第11期358-362,共5页袁野 徐闰 徐海涛 洪峰 徐飞 王林军 
supported by the National Natural Science Foundation of China(Grant No.11375112)
The electronic structures of cubic structure of ABX3(A=CH3NH3, Cs; B=Sn, Pb; X=Cl, Br, I) are analyzed by den- sity functional theory using the Perdew-Burke-Ernzerhof exchange-correlation functional and using the He...
关键词:first-principles theory electron density of states band structure of crystalline solids organicinorganic hybrid nanostructures 
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