4.7 Article

Why are para-hydrogen clusters superfluid? A quantum theorem of corresponding states study

期刊

JOURNAL OF CHEMICAL PHYSICS
卷 133, 期 6, 页码 -

出版社

AMER INST PHYSICS
DOI: 10.1063/1.3458640

关键词

Lennard-Jones potential; Monte Carlo methods; phase diagrams; quantum fluids; superfluidity; total energy

向作者/读者索取更多资源

The quantum theorem of corresponding states is applied to N=13 and N=26 cold quantum fluid clusters to establish where para-hydrogen clusters lie in relation to more and less quantum delocalized systems. Path integral Monte Carlo calculations of the energies, densities, radial and pair distributions, and superfluid fractions are reported at T=0.5 K for a Lennard-Jones (LJ) (12,6) potential using six different de Boer parameters including the accepted value for hydrogen. The results indicate that the hydrogen clusters are on the borderline to being a nonsuperfluid solid but that the molecules are sufficiently delocalized to be superfluid. A general phase diagram for the total and kinetic energies of LJ (12,6) clusters encompassing all sizes from N=2 to N=infinity and for the entire range of de Boer parameters is presented. Finally the limiting de Boer parameters for quantum delocalization induced unbinding (quantum unbinding) are estimated and the new results are found to agree with previous calculations for the bulk and smaller clusters. (C) 2010 American Institute of Physics. [doi:10.1063/1.3458640]

作者

我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。

评论

主要评分

4.7
评分不足

次要评分

新颖性
-
重要性
-
科学严谨性
-
评价这篇论文

推荐

暂无数据
暂无数据