Van der Waals potential and vibrational energy levels of the ground state radon dimer

被引:2
|
作者
Sheng, Xiaowei [1 ,2 ]
Qian, Shifeng [1 ]
Hu, Fengfei [1 ]
机构
[1] Anhui Normal Univ, Dept Phys, Wuhu 241000, Anhui, Peoples R China
[2] Anhui Prov Key Lab Optoelect Mat Sci & Technol, Wuhu 241000, Peoples R China
基金
中国国家自然科学基金;
关键词
DISPERSION COEFFICIENTS; COMBINING RULES; ATOMS; POLARIZABILITIES; MODEL; RN-2; XE-2; HE;
D O I
10.1016/j.chemphys.2017.06.013
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
In the present paper, the ground state van der Waals potential of the Radon dimer is described by the Tang-Toennies potential model, which requires five essential parameters. Among them, the two dispersion coefficients C-6 and C-8 are estimated from the well determined dispersion coefficients C-6 and C-8 of Xe-2. C-10 is estimated by using the approximation equation that C6C10/C-8(2) has an average value of 1.221 for all the rare gas dimers. With these estimated dispersion coefficients and the well determined well depth D-e and R-e the Born-Mayer parameters A and b are derived. Then the vibrational energy levels of the ground state radon dimer are calculated. 40 vibrational energy levels are observed in the ground state of Rn-2 dimer. The last vibrational energy level is bound by only 0.0012 cm(-1). (C) 2017 Elsevier B.V. All rights reserved.
引用
收藏
页码:111 / 114
页数:4
相关论文
共 50 条
  • [31] Recoil energy disposal in the vibrational predissociation of some van der Waals dimers.
    Yoder, LM
    Barker, JR
    Lorenz, KT
    Chandler, DW
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1999, 218 : U302 - U302
  • [32] Potential energy surfaces and predicted infrared spectra for van der Waals complexes: dependence on one intramolecular vibrational coordinate
    Xie, Daiqian
    Ran, Hong
    Zhou, Yanzi
    INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY, 2007, 26 (03) : 487 - 520
  • [33] Interplay of electrostatic and van der Waals forces in coronene dimer
    Obolensky, O. I.
    Semenikhina, V. V.
    Solov'yov, A. V.
    Greiner, W.
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2007, 107 (06) : 1335 - 1343
  • [34] Hydrogen atom in the instantaneous van der Waals potential: Pitchfork bifurcation and ro-vibrational structure of the energy spectrum
    Simonovic, NS
    Salas, JP
    PHYSICS LETTERS A, 2001, 279 (5-6) : 379 - 384
  • [35] Potential energy curve of the ground state of the titanium dimer
    Suzuki, Y
    Noro, T
    Sasaki, F
    Tatewaki, H
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1999, 461 : 351 - 357
  • [36] Generic van der Waals equation of state and statistical mechanical representations of the van der Waals parameters
    Eu, BC
    Rah, K
    PHYSICAL REVIEW E, 2001, 63 (03): : 031203 - 031203
  • [37] The retarded van der Waals potential: Revisited
    Miyao, Tadahiro
    Spohn, Herbert
    JOURNAL OF MATHEMATICAL PHYSICS, 2009, 50 (07)
  • [38] High accuracy ab initio potential energy surface for the H2O-H van der Waals dimer
    McCarver, Gavin A.
    Hinde, Robert J.
    JOURNAL OF CHEMICAL PHYSICS, 2021, 155 (11):
  • [39] An extension of the Van der Waals equation of state
    Tian, JX
    Gui, YX
    MODERN PHYSICS LETTERS B, 2004, 18 (5-6): : 213 - 220
  • [40] Modification to the Van der Waals equation of state
    Tian, JX
    Gui, YX
    JOURNAL OF PHASE EQUILIBRIA, 2003, 24 (06): : 533 - 541