Abstract
Classical lattice gases consisting of structureless particles (with spin) have been quantized by introducing a kinetic energy operator that produces nearest-neighbor hops. Systematic quantum corrections for the partition function and the particle distribution functions appear naturally as power series inX =βħ 2/2ml 2 (β −1 =k B T,m is the mass,l is a distance related to lattice spacing). These corrections require knowledge of certain particle displacement probabilities in the corresponding classical lattice gases. Leading-order corrections have been derived in forms that should facilitate their use in computer simulation studies of lattice gases by the standard Monte Carlo method.
Similar content being viewed by others
References
F. Cernuschi and H. Eyring,J. Chem. Phys. 7:547 (1939).
J. G. Kirkwood,J. Chem. Phys. 7:908 (1939).
T. D. Lee and C. N. Yang,Phys. Rev. 87:410 (1952).
L. Onsager,Phys. Rev. 65:117 (1944).
C. N. Yang,Phys. Rev. 85:808 (1952).
C. Domb,Adv. Phys. 9:245 (1960).
H. J. Leamy, G. H. Gilmer, K. A. Jackson, and P. Bennema,Phys. Rev. Lett. 30:601 (1973).
G. M. Bell,J. Phys. C: Solid State Phys. 5:889 (1972).
P. D. Fleming III and J. H. Gibbs,J. Stat. Phys. 10:157, 351 (1974).
D. R. Herrick and F. H. Stillinger,J. Chem. Phys. 65:1345 (1976).
T. Matsubara and H. Matsuda,Prog. Theor. Phys. 16:569 (1956).
H. Matsuda and T. Matsubara,Prog. Theor. Phys. 17:19 (1957).
R. T. Whitlock and P. R. Zilsel,Phys. Rev. 131:2409 (1963).
M. Abramowitz and I. Stegun,Handbook of Mathematical Functions (NBS Applied Mathematics Series, No. 55), U.S. GPO, Washington, D.C. (1964), Sect. 9.6.
R. P. Feynman,Statistical Mechanics, Benjamin (1972), p. 67.
N. Ogita, A. Ueda, T. Matsubara, H. Matsuda, and F. Yonezawa,J. Phys. Soc. Japan 26 (Suppl.):145 (1968).
A. B. Bortz, M. H. Kalos, and J. L. Lebowitz,J. Comp. Phys. 17:10 (1975).
E. Lieb,J. Math. Phys. 8:43 (1967).
R. N. Hill,J. Stat. Phys. 11:207 (1974).
M. E. Fisher,Phys. Rev. 176:257 (1968).
Author information
Authors and Affiliations
Rights and permissions
About this article
Cite this article
Stillinger, F.H. Quantum corrections for lattice gases. J Stat Phys 15, 407–421 (1976). https://doi.org/10.1007/BF01020343
Received:
Revised:
Issue Date:
DOI: https://doi.org/10.1007/BF01020343