Browsing "Faculty of Science" by Author sun, qiang

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Showing results 1 to 12 of 12
TitleAuthor(s)Issue Date
 
Dehydrogenation mechanisms of Ca(NH<inf>2</inf>BH<inf>3</inf>)<inf>2</inf>: The less the charge transfer, the lower the barrier
Journal:International Journal of Hydrogen Energy
Yuan, Peng FeiWang, FeiSun, QiangJia, YuGuo, Z. X.
2013
 
Effects of in-plane stiffness and charge transfer on thermal expansion of monolayer transition metal dichalcogenide
Journal:Chinese Physics B
Wang, Zhan YuZhou, Yan LiWang, Xue QingWang, FeiSun, QiangGuo, Zheng XiaoJia, Yu
2015
 
First-principles investigation of negative thermal expansion in II-VI semiconductors
Journal:Materials Chemistry and Physics
Wang, LeiYuan, Peng FeiWang, FeiSun, QiangGuo, Zheng XiaoLiang, Er JunJia, Yu
2014
 
First-principles study of tetragonal PbTiO<inf>3</inf>: Phonon and thermal expansion
Journal:Materials Research Bulletin
Wang, LeiYuan, PengfeiWang, FeiLiang, ErjunSun, QiangGuo, ZhengxiaoJia, Yu
2014
 
Negative thermal expansion correlated with polyhedral movements and distortions in orthorhombic Y<inf>2</inf>Mo<inf>3</inf>O<inf>12</inf>
Journal:Materials Research Bulletin
Wang, LeiWang, FeiYuan, Peng FeiSun, QiangLiang, Er JunJia, YuGuo, Zheng Xiao
2013
 
Negative thermal expansion in TiF<inf>3</inf> from the first-principles prediction
Journal:Physics Letters, Section A: General, Atomic and Solid State Physics
Wang, LeiYuan, Peng FeiWang, FeiSun, QiangLiang, Er JunJia, YuGuo, Zheng Xiao
2014
 
Recent advances in C-S bond formation via C-H bond functionalization and decarboxylation
Journal:Chemical Society Reviews
Shen, ChaoZhang, PengfeiSun, QiangBai, ShiqiangHor, T. S AndyLiu, Xiaogang
2015
 
Role of charge transfer in dehydrogenation of M(NH<inf>2</inf>BH<inf>3</inf>)<inf>2</inf> (M = Mg, Sr)
Journal:Journal of Physical Chemistry C
Yuan, Peng FeiSun, QiangJia, YuGuo, Z. X.
2014
 
Structural and reaction pathway analyses of Mg(BH<inf>4</inf>)<inf>2</inf>·2NH<inf>3</inf> for hydrogen storage: A first-principles study
Journal:International Journal of Hydrogen Energy
Yuan, Peng FeiWang, FeiSun, QiangJia, YuGuo, Z. X.
2013
 
Structural, energetic and thermodynamic analyses of Ca(BH<inf>4</inf>)<inf>2</inf>·2NH<inf>3</inf> from first principles calculations
Journal:Journal of Solid State Chemistry
Yuan, Peng FeiWang, FeiSun, QiangJia, YuGuo, Zheng Xiao
2012
 
Theoretical study of hydration in Y2Mo3O12: Effects on structure and negative thermal expansion
Journal:AIP Advances
Wu, Ming YiWang, LeiJia, YuGuo, Zheng XiaoSun, Qiang
2015
 
Van der Waals Effects on semiconductor clusters
Journal:Journal of Computational Chemistry
Li, HaishengChen, WeiguangHan, XiaoyuLi, LibenSun, QiangGuo, ZhengxiaoJia, Yu
2015
Showing results 1 to 12 of 12