Dimensional crossover of the fundamental-measure functional for parallel hard cubes

被引:82
作者
Cuesta, JA
MartinezRaton, Y
机构
[1] Grupo Interdisciplinar de Sistemas Complicados (GISC), Departamento de Matemáticas, Escuela Politécnica Superior, Universidad Carlos III de Madrid, Madrid, 28911, c/ Butarque
关键词
D O I
10.1103/PhysRevLett.78.3681
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
We present a regularization of the recently proposed fundamental-measure functional for a mixture of parallel hard cubes. The regularized functional is shown to have correct dimensional crossovers to any smaller dimension, thus allowing its use to study highly inhomogeneous phases (such as the solid phase). Furthermore, it is shown how the functional of the slightly more-general model of parallel hard parallelepipeds can be obtained using the zero-dimensional functional as a generating functional. Extensions to the multicomponent system, a restricted-orientation model, and mixtures or prallel hard cylinders are also given.
引用
收藏
页码:3681 / 3684
页数:4
相关论文
共 20 条
[1]  
[Anonymous], 1992, FUNDAMENTALS INHOMOG
[2]  
BAUS M, 1990, J PHYS-CONDENS MAT, V2, P2241
[3]   Fluid mixtures of parallel hard cubes [J].
Cuesta, JA .
PHYSICAL REVIEW LETTERS, 1996, 76 (20) :3742-3745
[4]   EVIDENCE FOR ENTROPY-DRIVEN DEMIXING IN HARD-CORE FLUIDS [J].
DIJKSTRA, M ;
FRENKEL, D .
PHYSICAL REVIEW LETTERS, 1994, 72 (02) :298-300
[5]   PHASE-SEPARATION IN BINARY HARD-CORE MIXTURES [J].
DIJKSTRA, M ;
FRENKEL, D ;
HANSEN, JP .
JOURNAL OF CHEMICAL PHYSICS, 1994, 101 (04) :3179-3189
[6]   Density functional theory for hard-sphere fluids: A generating function approach [J].
Gonzalez, A ;
White, JA ;
Evans, R .
JOURNAL OF PHYSICS-CONDENSED MATTER, 1997, 9 (11) :2375-2398
[7]   FREE-ENERGY DENSITY FUNCTIONAL FOR THE INHOMOGENEOUS HARD-SPHERE FLUID - APPLICATION TO INTERFACIAL ADSORPTION [J].
KIERLIK, E ;
ROSINBERG, ML .
PHYSICAL REVIEW A, 1990, 42 (06) :3382-3387
[8]   DENSITY-FUNCTIONAL THEORY FOR INHOMOGENEOUS FLUIDS - ADSORPTION OF BINARY-MIXTURES [J].
KIERLIK, E ;
ROSINBERG, ML .
PHYSICAL REVIEW A, 1991, 44 (08) :5025-5037
[9]   MELTING, FREEZING AND COLLOIDAL SUSPENSIONS [J].
LOWEN, H .
PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS, 1994, 237 (05) :249-324
[10]   FREE-ENERGY MODELS FOR NONUNIFORM CLASSICAL FLUIDS [J].
PERCUS, JK .
JOURNAL OF STATISTICAL PHYSICS, 1988, 52 (5-6) :1157-1178