Note: Heterogeneous ice nucleation on silver-iodide-like surfaces

被引：69

作者：

Fraux, Guillaume ^{[1
,2
]}

Doye, Jonathan P. K. ^{[1
]}

机构：

[1] Univ Oxford, Dept Chem, Phys & Theoret Chem Lab, Oxford OX1 3QZ, England

[2] Ecole Normale Super, F-75005 Paris, France

来源：

JOURNAL OF CHEMICAL PHYSICS | 2014年 / 141卷 / 21期

基金：

英国工程与自然科学研究理事会;

关键词：

WATER MONOLAYER CLUSTERS; ELECTRIC-FIELDS; MONTE-CARLO; MODEL; AGL; SIMULATIONS; SUBSTRATE;

D O I：

10.1063/1.4902382

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 attempt to simulate the heterogeneous nucleation of ice at model silver-iodide surfaces and find relatively facile ice nucleation and growth at the Ag+ terminated basal face, but never see nucleation at the I- terminated basal face or the prism and normal faces. Water molecules strongly adsorb onto the Ag+ terminated face to give a well-ordered hexagonal ice-like bilayer that then acts as a template for further ice growth. © 2014 AIP Publishing LLC.

引用

页数：2

共 26 条

[21] Ice nucleation by electric surface fields of varying range and geometry [J].

Yan, J. Y. ;

Patey, G. N. .

JOURNAL OF CHEMICAL PHYSICS, 2013, 139 (14)

[22] Molecular Dynamics Simulations of Ice Nucleation by Electric Fields [J].

Yan, J. Y. ;

Patey, G. N. .

JOURNAL OF PHYSICAL CHEMISTRY A, 2012, 116 (26) :7057-7064

[23] Heterogeneous Ice Nucleation Induced by Electric Fields [J].

Yan, J. Y. ;

Patey, G. N. .

JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2011, 2 (20) :2555-2559

[24] Crystallisation of ice in charged Pt nanochannel [J].

Zhang, X. X. ;

Lu, Y. J. ;

Chen, M. .

MOLECULAR PHYSICS, 2013, 111 (24) :3808-3814

[25] Icing of water on polyethylene surfaces [J].

Zhang, Xiang-Xiong ;

Chen, Min ;

Fu, Ming .

APPLIED SURFACE SCIENCE, 2014, 313 :771-776

[26]

Zielke S. A., J PHYS CHEM B

← 1 2 3 →