ON POLARIZATION EFFECTS IN ENDOHEDRAL FULLERENE COMPLEXES

被引：18

作者：

HERNANDEZROJAS, J

BRETON, J

LLORENTE, JMG

机构：

[1] Departamento de Física Fundamental y Experimental, Universidad de La Laguna

来源：

CHEMICAL PHYSICS LETTERS | 1995年 / 235卷 / 1-2期

关键词：

D O I：

10.1016/0009-2614(95)00136-R

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Recently proposed semiempirical analytical forms for the guest-host interaction potential of endohedral fullerene complexes are in mutual contradiction, as far as the significance of the polarization energy contribution is concerned. This issue is elucidated through a reliable estimate of the polarization energy.

引用

收藏

页码：160 / 162

页数：3

相关论文

共 17 条

[1] RADIAL VIBRATIONS OF A SODIUM-ION INSIDE ICOSAHEDRAL C-60 [J].

BALLESTER, JL ;

DUNLAP, BI .

PHYSICAL REVIEW A, 1992, 45 (11) :7985-7990

[2] ENDOHEDRAL AND EXOHEDRAL ADSORPTION IN C-60 - AN ANALYTICAL MODEL [J].

BRETON, J ;

GONZALEZPLATAS, J ;

GIRARDET, C .

JOURNAL OF CHEMICAL PHYSICS, 1993, 99 (05) :4036-4040

[3] NONLINEAR VIBRATIONAL DYNAMICS OF A NEON ATOM IN C-60 [J].

BUG, ALR ;

WILSON, A ;

VOTH, GA .

JOURNAL OF PHYSICAL CHEMISTRY, 1992, 96 (20) :7864-7869

[4] VIBRATIONAL PROPERTIES OF XE-FULLERENE ADDUCTS - A MOLECULAR-DYNAMICS APPROACH [J].

CARDINI, G ;

PROCACCI, P ;

SALVI, PR ;

SCHETTINO, V .

CHEMICAL PHYSICS LETTERS, 1992, 200 (1-2) :39-45

[5] THE GROUND AND EXCITED-STATES OF C60M AND C60M+ (M=O, F, K, CA, MN, CS, BA, LA, EU, U) [J].

CHANG, AHH ;

ERMLER, WC ;

PITZER, RM .

JOURNAL OF CHEMICAL PHYSICS, 1991, 94 (07) :5004-5010

[6] ENDOHEDRAL COMPLEXES - ATOMS AND IONS INSIDE THE C60 CAGE [J].

CIOSLOWSKI, J ;

FLEISCHMANN, ED .

JOURNAL OF CHEMICAL PHYSICS, 1991, 94 (05) :3730-3734

[7] ENDOHEDRAL CHEMISTRY - ELECTRONIC-STRUCTURES OF MOLECULES TRAPPED INSIDE THE C60 CAGE [J].

CIOSLOWSKI, J .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1991, 113 (11) :4139-4141

[8] INTERACTIONS BETWEEN C-60 AND ENDOHEDRAL ALKALI ATOMS [J].

DUNLAP, BI ;

BALLESTER, JL ;

SCHMIDT, PP .

JOURNAL OF PHYSICAL CHEMISTRY, 1992, 96 (24) :9781-9787

[9] ABINITIO THEORETICAL PREDICTIONS OF C28, C28H4, C28F4, (TI AT C28)H4, AND M AT C28 (M=MG, AL, SI, S, CA, SC, TI, GE, ZR, AND SN) [J].

GUO, T ;

SMALLEY, RE ;

SCUSERIA, GE .

JOURNAL OF CHEMICAL PHYSICS, 1993, 99 (01) :352-359

[10] A SEMIEMPIRICAL ANALYTICAL POTENTIAL FOR DIATOMIC-MOLECULES AT SPHERICAL FULLERENES [J].

HERNANDEZROJAS, J ;

BRETON, J ;

LLORENTE, JMG .

CHEMICAL PHYSICS LETTERS, 1994, 222 (1-2) :88-94