A QUANTUM-CHEMICAL APPROACH FOR THE ESTIMATION OF THE CAPACITY OF A METAL

被引：8
|
作者：
NAZMUTDINOV, RR
PROBST, M
HEINZINGER, K
机构：
[1] TECHNOL UNIV, KAZAN 420015, RUSSIA
[2] UNIV INNSBRUCK, INST ANORGAN & ANALYT CHEM, A-6020 INNSBRUCK, AUSTRIA
来源：
CHEMICAL PHYSICS LETTERS | 1994年 / 221卷 / 3-4期
关键词：
D O I：
10.1016/0009-2614(94)00249-5
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：
The metal capacity C(Me) for the Pt(100)/H2O interface has been calculated in terms of a cluster model as a function of the electrode charge using results of MD simulations. The function C(Me) was found to be negative and to decrease with positive surface charges. It has been shown that the total capacity of the compact layer increases with the anodic Polarization.
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页码：224 / 229
页数：6
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