Calculation of magnetization by path integral method

被引:3
|
作者
Kawakami, T
Nagao, H
Mori, W
Yamaguchi, K
机构
[1] OSAKA NATL RES INST,DEPT OPT MAT,IKEDA,OSAKA 563,JAPAN
[2] KANAGAWA UNIV,FAC SCI,DEPT CHEM,HIRATSUKA,KANAGAWA 25912,JAPAN
关键词
ab initio quantum chemical methods and calculations; magnetic phase transitions;
D O I
10.1016/S0379-6779(97)80423-7
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Theoretical studies of magnetic properties have been carried out and we have progressed the numerical treatment of those by the path integral method. In this method the numerical partition function can be calculated directly and is applied to numerical studies of the magnetization including temperature effect. The path integral method is formulated by means of the Thouless parametrization and progressed with the Monte Carlo method. We present the numerical calculations for a simple molecular system, i.e, the CU2+ - H (d(9) - s) system, which is related to the Ti3+ - H (d(1) - s) system as discussed previously and considered as a hole doped system. Finally, it is found that our method can lead its magnetic behaviors successfully.
引用
收藏
页码:1753 / 1754
页数:2
相关论文
共 50 条
  • [31] The application of path integral for log return probability calculation
    Palupi, D. S.
    Hermanto, A.
    Tenderlilin, E.
    Rosyid, M. F.
    CONFERENCE OF THEORETICAL PHYSICS AND NONLINEAR PHENOMENA (CTPNP) 2014 - FROM UNIVERSE TO STRING'S SCALE, 2014, 539
  • [32] Path integral Monte Carlo calculation of the deuterium Hugoniot
    Militzer, B
    Ceperley, DM
    PHYSICAL REVIEW LETTERS, 2000, 85 (09) : 1890 - 1893
  • [33] SEMI-CLASSICAL CALCULATION OF A RADIAL PATH INTEGRAL
    GERRY, CC
    INOMATA, A
    JOURNAL OF MATHEMATICAL PHYSICS, 1982, 23 (12) : 2402 - 2407
  • [34] PATH INTEGRAL CALCULATION OF ENTANGLEMENT PROBABILITIES FOR BOUND MACROMOLECULES
    TANIKELLA, V
    INOMATA, A
    PHYSICS LETTERS A, 1982, 87 (04) : 196 - 200
  • [36] Path integral calculation of the writhe for circular semiflexible polymers
    Kholodenko, AL
    Vilgis, TA
    JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL, 1996, 29 (05): : 939 - 948
  • [37] Path integral Monte Carlo calculation of electronic forces
    Zong, FH
    Ceperley, DM
    PHYSICAL REVIEW E, 1998, 58 (04) : 5123 - 5130
  • [38] PATH INTEGRAL CALCULATION OF QUANTUM STATISTICAL DENSITY MATRIX
    STORER, RG
    KLEMM, AD
    BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1970, 15 (02): : 188 - &
  • [39] Path Integral approach to stochastic magnetization dynamics in uniaxial ferromagnetic nanoparticles
    Dip. di Ingegneria Elettrica, Università di Napoli Federico II, Napoli 80125, Italy
    不详
    不详
    不详
    不详
    IEEE Trans Magn, 2008, 11 PART 2 (3157-3160):
  • [40] Path Integral Approach to Stochastic Magnetization Dynamics in Uniaxial Ferromagnetic Nanoparticles
    Serpico, C.
    Bertotti, G.
    d'Aquino, M.
    Ragusa, C.
    Ansalone, P.
    Mayergoyz, I. D.
    IEEE TRANSACTIONS ON MAGNETICS, 2008, 44 (11) : 3157 - 3160