Towards SiC surface functionalization: An ab initio study

被引：25

作者：

Cicero, G ^{[1
]}

Catellani, A

机构：

[1] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA

[2] CNR, IMEM, I-43100 Parma, Italy

来源：

JOURNAL OF CHEMICAL PHYSICS | 2005年 / 122卷 / 21期

关键词：

D O I：

10.1063/1.1924546

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：

We present a microscopic model of the interaction and adsorption mechanism of simple organic molecules on SiC surfaces as obtained from ab initio molecular-dynamics simulations. Our results open the way to functionalization of silicon carbide, a leading candidate material for biocompatible devices. (c) 2005 American Institute of Physics.

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页数：5

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