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Other articles related with "first-principles theory"：
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67803 |
Ying-Ying Yang(杨莹莹), Pei Gong(龚裴), Wan-Duo Ma(马婉铎), Rui Hao(郝锐), and Xiao-Yong Fang(房晓勇) |
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Effects of substitution of group-V atoms for carbon or silicon atoms on optical properties of silicon carbide nanotubes |
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Chin. Phys. B
2021 Vol.30 (6): 67803-067803
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26301 |
Jia Shi(史佳), Lei Wang(王蕾), and Qiang Gu(顾强) |
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First-principles study of the co-effect of carbon doping and oxygen vacancies in ZnO photocatalyst |
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Chin. Phys. B
2021 Vol.30 (2): 26301-0
[Abstract]
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(56)
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37304 |
Ya-Lin Li(李亚林), Pei Gong(龚裴), Xiao-Yong Fang(房晓勇) |
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Comparative study on transport properties of N-, P-, and As-doped SiC nanowires: Calculated based on first principles |
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Chin. Phys. B
2020 Vol.29 (3): 37304-037304
[Abstract]
(624)
[HTML 1 KB]
[PDF 1418 KB]
(118)
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126103 |
Chuan-Yu Zhang(张传瑜), Xu-Ben Wang(王绪本), Xiao-Feng Zhao(赵晓凤), Xing-Run Chen(陈星润), You Yu(虞游), Xiao-Feng Tian(田晓峰) |
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First-principles calculations of structure and elasticity of hydrous fayalite under high pressure |
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Chin. Phys. B
2017 Vol.26 (12): 126103-126103
[Abstract]
(523)
[HTML 0 KB]
[PDF 933 KB]
(288)
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47309 |
Yan-Jing Li(李彦景), Ya-Lin Li(李亚林), Shu-Long Li(李树龙), Pei Gong(龚裴), Xiao-Yong Fang(房晓勇) |
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Structural, electronic, and optical properties of hexagonal and triangular SiC NWs with different diameters |
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Chin. Phys. B
2017 Vol.26 (4): 47309-047309
[Abstract]
(666)
[HTML 1 KB]
[PDF 1555 KB]
(364)
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127307 |
Yu Xiao-Xia (于晓霞), Zhou Yan (周彦), Liu Jia (刘甲), Jin Hai-Bo (金海波), Fang Xiao-Yong (房晓勇), Cao Mao-Sheng (曹茂盛) |
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Structures and electrical properties of pure and vacancy-included ZnO NWs of different sizes |
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Chin. Phys. B
2015 Vol.24 (12): 127307-127307
[Abstract]
(675)
[HTML 1 KB]
[PDF 1477 KB]
(496)
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116302 |
Yuan Ye (袁野), Xu Run (徐闰), Xu Hai-Tao (徐海涛), Hong Feng (洪峰), Xu Fei (徐飞), Wang Lin-Jun (王林军) |
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Nature of the band gap of halide perovskites ABX3 (A= CH3NH3, Cs; B= Sn, Pb; X= Cl, Br, I): First-principles calculations |
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Chin. Phys. B
2015 Vol.24 (11): 116302-116302
[Abstract]
(1008)
[HTML 1 KB]
[PDF 1327 KB]
(1899)
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126102 |
Zheng Hong-Mei (郑红梅), Fang Xiao-Yong (房晓勇), Cai Li-Xia (蔡丽霞), Yin Ai-Cha (尹爱查), Jin Hai-Bo (金海波), Yu Xiao-Xia (于晓霞), Cao Mao-Sheng (曹茂盛) |
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Effects of N doping on photoelectric properties of along different directions of ZnO bulk and nanotube |
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Chin. Phys. B
2014 Vol.23 (12): 126102-126102
[Abstract]
(515)
[HTML 1 KB]
[PDF 781 KB]
(455)
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109102 |
Wu Qiong (吴琼), Li Shu-Suo (李树索), Ma Yue (马岳), Gong Sheng-Kai (宫声凯) |
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First principles calculations of alloying element diffusion coefficients in Ni using the five-frequency model |
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Chin. Phys. B
2012 Vol.21 (10): 109102-109102
[Abstract]
(1161)
[HTML 1 KB]
[PDF 161 KB]
(2820)
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