CALCULATION OF ADSORPTION ENERGIES OF NORMAL-ALKANE MOLECULES ON (001) FACE OF CRYSTALS OF LONG-CHAIN EVEN NORMAL-ALKANES

被引：15

作者：

BOISTELLE, R ^{[1
]}

MADSEN, HEL ^{[1
]}

机构：

[1] KVL,KEMISK INST,THORVALDSENSVEJ 40,DK-1871 KOBENHAVN 5,DENMARK

来源：

JOURNAL OF CRYSTAL GROWTH | 1978年 / 43卷 / 02期

关键词：

D O I：

10.1016/0022-0248(78)90161-6

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

A model for the adsorption of n-alkane molecules on the (001) face of monoclinic even n-alkane crystals is proposed. It is used for calculations of adsorption energies at the crystal-vapour as well as at the crystal-solution interface. The energy of interaction between the molecules is obtained from the Lennard-Jones 6-12 potential. © 1978.

引用

页码：141 / 147

页数：7

共 17 条

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