The structure and stability of atomic liquids: From clusters to bulk

被引:147
作者
Doye, JPK
Wales, DJ
机构
[1] University Chemical Laboratories, Cambridge CB2 1EW, Lensfield Road
关键词
D O I
10.1126/science.271.5248.484
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
Insights into the structure of simple liquids are presented from analysis of the effect of the range of interatomic forces on the multidimensional potential energy surfaces of bulk material and clusters. An understanding al the microscopic level is provided of how the liquid phase is destabilized in systems with very short-range interparticle forces. For small clusters bound by long-range interatomic forces, the lowest energy minimum has an amorphous structure typical of the liquidlike state. This suggests an explanation for the transition from electronic to geometric magic numbers (structures of special stability) observed in the mass spectra of sodium clusters.
引用
收藏
页码:484 / 487
页数:4
相关论文
共 25 条
[1]  
[Anonymous], SOLID STATE PHYS
[2]   EXPERIMENTAL PHASE-DIAGRAMS OF POLYMER AND COLLOID MIXTURES [J].
CALDERON, FL ;
BIBETTE, J ;
BIAIS, J .
EUROPHYSICS LETTERS, 1993, 23 (09) :653-659
[3]   PREDICTION OF THE PHASE-DIAGRAM OF RIGID C-60 MOLECULES [J].
CHENG, A ;
KLEIN, ML ;
CACCAMO, C .
PHYSICAL REVIEW LETTERS, 1993, 71 (08) :1200-1203
[4]   MAKING A (COLLOIDAL) LIQUID - A VAN-DER-WAALS APPROACH [J].
COUSSAERT, T ;
BAUS, M .
PHYSICAL REVIEW E, 1995, 52 (01) :862-869
[5]   CALCULATION OF THERMODYNAMIC PROPERTIES OF SMALL LENNARD-JONES CLUSTERS INCORPORATING ANHARMONICITY [J].
DOYE, JPK ;
WALES, DJ .
JOURNAL OF CHEMICAL PHYSICS, 1995, 102 (24) :9659-9672
[6]   THE EFFECT OF THE RANGE OF THE POTENTIAL ON THE STRUCTURES OF CLUSTERS [J].
DOYE, JPK ;
WALES, DJ ;
BERRY, RS .
JOURNAL OF CHEMICAL PHYSICS, 1995, 103 (10) :4234-4249
[7]   COMPLEX ALLOY STRUCTURES REGARDED AS SPHERE PACKINGS .1. DEFINITIONS AND BASIC PRINCIPLES [J].
FRANK, FC ;
KASPER, JS .
ACTA CRYSTALLOGRAPHICA, 1958, 11 (03) :184-190
[8]   COMPLEX ALLOY STRUCTURES REGARDED AS SPHERE PACKING .2. ANALYSIS AND CLASSIFICATION OF REPRESENTATIVE STRUCTURES [J].
FRANK, FC ;
KASPER, JS .
ACTA CRYSTALLOGRAPHICA, 1959, 12 (07) :483-499
[9]   SUPERCOOLING OF LIQUIDS [J].
FRANK, FC .
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1952, 215 (1120) :43-46
[10]   POLYMER-INDUCED PHASE SEPARATIONS IN NON-AQUEOUS COLLOIDAL SUSPENSIONS [J].
GAST, AP ;
HALL, CK ;
RUSSEL, WB .
JOURNAL OF COLLOID AND INTERFACE SCIENCE, 1983, 96 (01) :251-267