您当前所在位置: 首页 > 学者
在线提示

恭喜!关注成功

在线提示

确认取消关注该学者?

邀请同行关闭

只需输入对方姓名和电子邮箱,就可以邀请你的同行加入中国科技论文在线。

真实姓名:

电子邮件:

尊敬的

我诚挚的邀请你加入中国科技论文在线,点击

链接,进入网站进行注册。

添加个性化留言

已为您找到该学者13条结果 成果回收站

上传时间

2007年09月17日

【期刊论文】Analytic Debye-Gruneisen equation of state for a generalized Lennard-Jones solids

孙久勋, Sun Jiu-Xun, Wu Qiang, Cai Ling-Cang, and Jing Fu-Qian

Chinese Physics Vol. 12 NO. 6, June 2003,-0001,():

-1年11月30日

摘要

The approximate method to treat the practical quantum anharmonic solids proposed by Hardy. Lacks and Shukla is reformulated with explicit physical meanings. It is shown that the quantum effect is important at low temperature, it at be treated in the harmonic framework; and the anharmonic effect is important at high temperature and tends to zero at low temperature, it can be treated by using a classical approximation. The alternative formulation is easier for various applications, and is applied to a Debye-Gruneisen aolid with the generalized Lennard-Jones intermolecular interaction. The expressions for the Debye temperature and Grunelsen parameter as a function of volume are analytically derived. The analytic equation of state is applied to predict the thermodynamic properties of solid xenon at normal pressure with the nearest-neighbour Lennard-Jones interaction, and is further applied to research the properties of solid xenon and krypton at high pressure by using an all-neighbour Lennard-Jones interaction. The theoretical results are in agreement with the experiments.

equation of state, analyticity, generalized Lennard-Jones solid, thermodynamic properties

上传时间

2007年09月17日

【期刊论文】Analytic cell-cluster expansion theory and its extension to the quantum case

孙久勋, Jiuxun Sun

Physica B 315(2002)101-110,-0001,():

-1年11月30日

摘要

The cell-cluster expansion theory is analytically expanded with the anharmonic and the lowest order correlation effects taken into account. The thermodynamic quantities for the all-neighbor and the nearest-neighbor Lennard-Jones models are calculated. The results show that the agreement of the analytic approximate theory with the complete one and the computer simulation is quite good. The comparison also shows that the contributions of the non-nearest neighbors to the thermal parts of thermodynamic quantities are larger than the second-order correlation modification. The ignorance of second-order correlation modification is a reasonable and practically convenient approximation. A simple method is proposed to extend the analytic approximate theory to the quantum case. Considering the quantum effect is remarkable only at low temperature, and tends zero at high temperature, the potential energy of an atom is harmonically expanded to consider the quantum effect of solids within the harmonic oscillator framework. The anharmonic effect is remarkable only at high temperature, and tends zero at low temperature, it is disposed using a classical approximation. The results for the quantum theory are in good agreement with the experimental data of solid xenon.

Cell-cluster expansion, Anharmonicity, Quantum

上传时间

2007年09月17日

【期刊论文】Amodified Lennard-Jones-type equation of state for solids strictly satisfying the spinodal condition

孙久勋, Sun Jiuxun

INSTITUTE OF PHYSICS PUBLISHING JOUARNAL OF PHYSICS: CONDENSED MATTER J, Phys. : Condens. Matter 17(2005)L103-L111,-0001,():

-1年11月30日

摘要

In this letter, it is pointed out that an ideal universal equation of state (EOS) of solids should have four merits. The EOS corresponding to the generalized Lennard-Jones (GLJ) potential is derived. It is pointed out that the GLJ EOS is not volume analytic, as the exponents contained in the potential function take arbitrary values. On making the exponents satisfy a relationship, the GLJ EOS becomes volume analytic with two parameters (mGLJ EOS), and has all four merits. By applying six EOSs in investigating 50 materials, it is shown that the mGLJ EOS gives the best results.

合作学者

  • 孙久勋 邀请

    电子科技大学,四川

    尚未开通主页