A QUANTUM-CHEMICAL INVESTIGATION OF THE INTERACTION OF ORGANIC-MOLECULES AND POLYMERS WITH GRAPHITE - COMPARISON WITH THE STM IMAGING OF ORGANIC ADSORBATES

被引：3

作者：

LAMBIN, G

DELVAUX, MH

CALDERONE, A

LAZZARONI, R

BREDAS, JL

CLARKE, TC

RABE, JP

机构：

[1] IBM CORP, ALMADEN RES CTR, SAN JOSE, CA 95120 USA

[2] MAX PLANCK INST POLYMER RES, W-6500 MAINZ, GERMANY

来源：

SYNTHETIC METALS | 1993年 / 57卷 / 2-3期

关键词：

D O I：

10.1016/0379-6779(93)90751-H

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

We investigate the adsorption of organic molecules and polymers onto the graphite surface with a quantum chemical approach. For this purpose, we study the geometry, the energetics and the electronic structure in a series of model systems, consisting of small molecules (CH4, H2O, H2S, CF4, benzene) interacting with one benzene molecule. Our results are interpreted in the framework of the STM imaging of organic molecules and polymers on graphite substrates.

引用

页码：4365 / 4370

页数：6

共 7 条

[1] THEORETICAL-STUDIES OF THE COMPLEXES OF BENZENE AND PYRENE WITH WATER AND OF BENZENE WITH FORMIC-ACID, AMMONIA, AND METHANE [J].