Kim Eun-Young, Kim Soon-Chul, Suh Soong-Hyuck
Department of Physics, Andong National University, Andong 760-749, Korea.
Phys Rev E Stat Nonlin Soft Matter Phys. 2012 May;85(5 Pt 1):051203. doi: 10.1103/PhysRevE.85.051203. Epub 2012 May 14.
A density functional perturbation theory, which is based both on the modified fundamental-measure theory and on the first-order mean-spherical approximation for long-range attractive and repulsive interactions, has been developed for studying the structure and phase behaviors of a competing system restricted to slit pores. The hysteresis loop for the adsorption and desorption curves indicates that the system exhibits vapor-cluster and cluster-liquid transitions which depend on the pair potential parameters and the slit width (H). The periodic spacing (D) of the cluster is commensurate with the periodicity of modulation in the particle density distribution and more closely related to the vapor-cluster and cluster-liquid phase transitions of the system. For the cluster phase, we find the transition from a single liquidlike slab to a multi-liquidlike slab with increasing the slit width. The multi-liquidlike slab is formed depending on the periodicity of modulation by finite-size artifacts. The cluster-related phase transitions, such as the vapor-cluster or cluster-liquid transitions occur for H>D, while for H<D the system only exhibits the vapor-liquid transition. At a low amplitude, the vapor-liquid transition disappears and the cluster-liquid transition only occurs for H<D. The coexistence curves for the confined phase diagram are contained within the corresponding bulk liquid-vapor coexistence curve. For a wide slit pore (H>D), the system exhibits two tricritical points, joined to one another by the line of second-order transition. The results support the conclusion that the confinement effect plays an important role in determining the equilibrium phase transition.
一种基于修正的基本度量理论以及长程吸引和排斥相互作用的一阶平均球近似的密度泛函微扰理论已被开发出来,用于研究限制在狭缝孔中的竞争系统的结构和相行为。吸附和解吸曲线的滞后回线表明,该系统表现出取决于对势参数和狭缝宽度(H)的气团和团簇 - 液相转变。团簇的周期性间距(D)与粒子密度分布中的调制周期性相称,并且与系统的气团和团簇 - 液相转变更密切相关。对于团簇相,我们发现随着狭缝宽度增加,从单个类液板向多个类液板转变。多个类液板是由有限尺寸效应根据调制周期性形成的。与团簇相关的相变,如气团或团簇 - 液相转变,发生在H > D时,而当H < D时,系统仅表现出气 - 液相变。在低振幅下,气 - 液相变消失,仅在H < D时发生团簇 - 液相变。受限相图的共存曲线包含在相应的体相液 - 气共存曲线内。对于宽狭缝孔(H > D),系统表现出两个三临界点,由二阶转变线连接。结果支持了限制效应在确定平衡相变中起重要作用这一结论。