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Studies on thermodynamic properties of III-V compounds by first-principles response-function calculation 期刊论文
Physica Status Solidi B-Basic Solid State Physics, Physica Status Solidi B-Basic Solid State Physics, 2009, 2009, 卷号: 246, 246, 期号: 7, 页码: 1618-1627, 1618-1627
作者:  S. Q. Wang
Adobe PDF(1027Kb)  |  收藏  |  浏览/下载:98/0  |  提交时间:2012/04/13
Ab-initio Calculation  Ab-initio Calculation  Bond-charge Model  Bond-charge Model  Space Gaussian  Space Gaussian  Pseudopotentials  Pseudopotentials  Temperature Thermal-expansion  Temperature Thermal-expansion  Lattice-dynamical  Lattice-dynamical  Properties  Properties  Pressure Dependences  Pressure Dependences  Gruneisen Parameters  Gruneisen Parameters  Phonon  Phonon  Dispersions  Dispersions  Elastic Properties  Elastic Properties  Electron-gas  Electron-gas  
Ab initio investigation of the pressure dependences of phonon and dielectric properties for III-V semiconductors 期刊论文
Journal of Physics-Condensed Matter, 2005, 卷号: 17, 期号: 28, 页码: 4475-4488
作者:  S. Q. Wang;  H. Q. Ye
收藏  |  浏览/下载:59/0  |  提交时间:2012/04/14
Lattice-dynamical Properties  Functional Perturbation-theory  Bond-orbital Model  Effective Charges  Lonsdaleite Phases  Raman-scattering  Force-constants  1st-principles  Crystals  Diamond