SOME STATIC AND VIBRATIONAL PROPERTIES OF ALUMINUM BY A LOCAL PSEUDOPOTENTIAL

被引:17
作者
GAJJAR, PN [1 ]
THAKORE, BY [1 ]
LUHAR, JS [1 ]
JANI, AR [1 ]
机构
[1] SARDAR PATEL UNIV,DEPT PHYS,VALLABH VIDYANAGAR 388120,GUJARAT,INDIA
来源
PHYSICA B | 1995年 / 215卷 / 04期
关键词
D O I
10.1016/0921-4526(95)00423-6
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
The pseudopotential investigation of various properties of aluminium is studied in terms of the real-space sum of Born-von Karman central-force constants. A simple local model potential depending on a single parameter has been used to investigate the ion-ion interaction, interatomic force constants, dynamical elastic constants, bulk modulus, deviation from Cauchy relation, Poisson's ratio, Young's modulus, propagation velocity of elastic waves, phonon dispersion curves and degree of elastic anisotropy. The effect of exchange and correlation on conduction electrons is also considered separately by using various forms of the dielectric (screening) functions. Overall good agreement with the available theoretical and experimental data is achieved in the present work.
引用
收藏
页码:293 / 304
页数:12
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