CALCULATED ELECTRON-DENSITY DISTRIBUTIONS IN SCS AND SC3S4

被引：6

作者：

FRANZEN, HF

NAKAHARA, JF

MISEMER, DK

机构：

[1] IOWA STATE UNIV SCI & TECHNOL,DEPT CHEM,AMES,IA 50011

[2] IOWA STATE UNIV SCI & TECHNOL,DEPT PHYS,AMES,IA 50011

来源：

JOURNAL OF SOLID STATE CHEMISTRY | 1986年 / 61卷 / 03期

关键词：

ELECTRONS;

D O I：

10.1016/0022-4596(86)90040-X

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

Previously calculated wavefunctions were used to calculate electron densities as functions of position within spheres surrounding Sc and S in scandium monosulfide and a hypothetical structure for the known scandium-deficient compound. The electron densities in the valence and conduction energy intervals are compared and interpreted in terms of the directionality of the electronic interactions in the compounds.

引用

页码：338 / 342

页数：5

共 5 条

[1] PREPARATION PROPERTIES + CRYSTAL STRUCTURES OF SOME SCANDIUM SULFIDES IN RANGE SC2S3-SCS [J].