,First-principles study of the elastic constants and optical properties of uranium metal

来源 :中国物理B(英文版) | 被引量 : 0次 | 上传用户:supercamel1987
下载到本地 , 更方便阅读
声明 : 本文档内容版权归属内容提供方 , 如果您对本文有版权争议 , 可与客服联系进行内容授权或下架
论文部分内容阅读
We perform first-principles calculations of the lattice constants,elastic constants,and optical properties for alphaand gamma-uranium based on the ultra-soft pseudopotential method.Lattice constants and equilibrium atomic volume are consistent pretty well with the experimental results.Some difference exists between our calculated elastic constants and the experimental data.Based on the satisfactory ground state electronic structure calculations,the optical conductivity,dielectric function,refractive index,and extinction coefficients are also obtained.These calculated optical properties are compared with our results and other published experimental data.
其他文献
1、穗粒灵穗粒灵是福建省尤溪县科技开发中心高级农艺师刘文炳研究成功的,穗粒灵具有调节剂、微肥和营养素等三方面功能。穗粒灵Ⅰ号,在水稻小穗分化3~4期,每亩用50毫升,兑水
The N-doping effects on the electronic properties of Cu2O crystals are investigated using density functional theory.The calculated results show that N-doped Cu2
山东是夏大豆主要产区,为了适应农业结构调整和发展高产高效农业的需要,我们积极开展了大豆高产、优质、抗病新品种的选育。经过多年的培育,选育出高产、抗病适合一年两作及
松香草属国家A级高蛋白饲草,自国外引入试种,效益十分显著,特别是随着畜牧业的全面发展,饲料主粮玉米、高粱、麸皮、豆饼价格不断高涨,专家呼吁:我国乡村推广种植松香草已势