Energy components in a lattice of ions and dipoles: Application to the K(THF)(x)C-24 compounds (x=1,2)

被引：9

作者：

Charlier, A ^{[1
]}

Setton, R ^{[1
]}

Charlier, MF ^{[1
]}

机构：

[1] CNRS,CRMD,F-45071 ORLEANS 2,FRANCE

来源：

PHYSICAL REVIEW B | 1997年 / 55卷 / 23期

关键词：

D O I：

10.1103/PhysRevB.55.15537

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

The ion-ion, ion-dipole, and dipole-dipole interaction energies of a three-component crystal; lattice are explained and calculated by the Ewald-Kornfeld method, and the relationships thus derived are applied to the K(THF)(x)C-24 (x = 1 or 2, THF denotes tetrahydrofuran) intercalation compounds of graphite to obtain information on the orientation of the dipolar THF molecules in the lattice.

引用

页码：15537 / 15543

页数：7

共 31 条

[1]

BANOS JO, 1984, THESIS U AIX MARSEIL

[2] The electron diffraction investigation of the molecular structures of tetrahdrofurar 2,5-dihydrofuran, furan, dioxadiene and p-dioxene [J].