Sartarelli Salvador A, Szybisz Leszek, Urrutia Ignacio
Instituto de Desarrollo Humano, Universidad Nacional de General Sarmiento, Gutierrez 1150, RA-1663 San Miguel, Argentina.
Phys Rev E Stat Nonlin Soft Matter Phys. 2009 Jan;79(1 Pt 1):011603. doi: 10.1103/PhysRevE.79.011603. Epub 2009 Jan 14.
A density functional formalism is applied to investigate the wetting behavior of Ne adsorbed on planar substrates. The study is performed over the complete range of temperatures spanned from the triple point T_{t} up to the critical one T_{c} . For this purpose, an effective attractive pair potential was built on the basis of a separation procedure. This approach yields a good description of properties of the liquid-vapor interface at coexistence in the whole range of temperatures T_{t} < or = T < or = T_{c} . The adsorption of Ne on alkali metals and the alkaline-earth metal Mg is analyzed. This sequence of substrates exhibit increasing attractive strength leading to a variety of wetting situations throughout the interval T_{t}<-->T_{c} . A comparison with experimental data and other microscopic calculations is done. The predictions of a simple model are discussed. For NeRb we were able to resolve prewetting lines. Results obtained from a density functional are reported for NeK and NeMg . In the case of the latter system the interesting behavior occurs close to T_{t} . According to our results, Ne wets surfaces of Na and Li, and this statement is in agreement with the whole picture of the analyzed substrates.
应用密度泛函形式来研究吸附在平面基底上的氖的润湿行为。该研究在从三相点(T_{t})到临界点(T_{c})的整个温度范围内进行。为此,基于一种分离程序构建了有效的吸引对势。这种方法能够很好地描述在整个温度范围(T_{t} \leq T \leq T_{c})内共存时液 - 气界面的性质。分析了氖在碱金属和碱土金属镁上的吸附情况。这一系列基底表现出不断增强的吸引强度,从而在整个(T_{t})到(T_{c})区间导致了多种润湿情况。与实验数据和其他微观计算进行了比较。讨论了一个简单模型的预测结果。对于氖 - 铷,我们能够解析出预润湿线。报告了从密度泛函得到的氖 - 钾和氖 - 镁的结果。在后者的体系中,有趣的行为发生在接近(T_{t})时。根据我们的结果,氖会润湿钠和锂的表面,这一说法与所分析基底的整体情况相符。