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Density functional theory investigation of the phonon instability, thermal equation of state and melting curve of Mo 期刊论文
Physical Chemistry Chemical Physics, 2011, 卷号: 13, 期号: 4, 页码: 1669-1675
作者:  Z. Y. Zeng;  C. E. Hu;  X. R. Chen;  X. L. Zhang;  L. C. Cai;  F. Q. Jing
Adobe PDF(982Kb)  |  收藏  |  浏览/下载:90/0  |  提交时间:2012/04/13
X-ray-diffraction  Shock Compression  Transition-metals  Molybdenum  Pressure  Behavior  Gradient  Gpa  Ta  
Probing the structural and magnetic properties of transition metal-benzene anion complexes 期刊论文
Dalton Transactions, 2011, 卷号: 40, 期号: 17, 页码: 4578-4589
作者:  H. F. Li;  X. Y. Kuang;  H. Q. Wang
Adobe PDF(2431Kb)  |  收藏  |  浏览/下载:102/0  |  提交时间:2012/04/13
Density-functional Theory  Decker Sandwich Clusters  Photoelectron-spectroscopy  Gas-phase  Electronic-structure  Ionization  Energies  Mass-spectrometry  Binding-energies  Ion-benzene  Atoms  
Bandgap narrowing of titanium oxide nanosheets: homogeneous doping of molecular iodine for improved photoreactivity 期刊论文
Journal of Materials Chemistry, 2011, 卷号: 21, 期号: 38, 页码: 14672-14679
作者:  G. Liu;  C. H. Sun;  L. Z. Wang;  S. C. Smith;  G. Q. Lu;  H. M. Cheng
Adobe PDF(507Kb)  |  收藏  |  浏览/下载:137/0  |  提交时间:2012/04/13
Visible-light Photocatalysis  Doped Tio2  Surface Science  Tantalum  Oxide  Photoactivity  Dioxide  Anatase  Degradation  Irradiation  Mechanisms  
First-principles study of the ferroelectric and nonlinear optical properties of the LiNbO(3)-type ZnSnO(3) 期刊论文
Physical Chemistry Chemical Physics, 2010, 卷号: 12, 期号: 32, 页码: 9197-9204
作者:  J. Zhang;  K. L. Yao;  Z. L. Liu;  G. Y. Gao;  Z. Y. Sun;  S. W. Fan
Adobe PDF(1195Kb)  |  收藏  |  浏览/下载:126/0  |  提交时间:2012/04/13
Functional Perturbation-theory  Solids  Polarization  Lo  Pseudopotentials  Coefficients  Crystals  Exchange  Phonons  Oxides  
Thermal properties and thermal shock resistance of gamma-Y2Si2O7 期刊论文
Journal of the American Ceramic Society, 2008, 卷号: 91, 期号: 8, 页码: 2623-2629
作者:  Z. Q. Sun;  Y. C. Zhou;  J. Y. Wang;  M. S. Li
Adobe PDF(480Kb)  |  收藏  |  浏览/下载:160/0  |  提交时间:2012/04/13
Silicon-nitride  Heat-capacity  Mechanical-properties  Stress  Resistance  Barrier Coatings  Flash Method  Ceramics  Conductivity  Diffusivity  Temperature