COOPERATIVE EFFECTS IN SIMULATED WATER

被引：341
作者：
BARNES, P
FINNEY, JL
NICHOLAS, JD
QUINN, JE
机构：
[1] Department of Crystallography, Birkbeck College, University of London, London WC1, Malet Street
来源：
NATURE | 1979年 / 282卷 / 5738期
关键词：
D O I：
10.1038/282459a0
中图分类号：
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号：
07 ; 0710 ; 09 ;
摘要：
Computer simulation calculations on liquid water, aqueous solutions and biological interfaces have been made almost universally assuming pair-additive interactions. Experimental and theoretical evidence implies this is a serious oversimplification. The development and testing of a different approach is reviewed in which many-body forces are specifically taken into account through molecular polarisation. Solution and interfacial properties of aqueous systems are particularly sensitive to such forces. © 1979 Nature Publishing Group.
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页码：459 / 464
页数：6
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