Configurational entropy of hard spheres

被引:54
|
作者
Angelani, Luca
Foffi, Giuseppe
机构
[1] Univ Roma La Sapienza, CNR, INFM, Res Ctr,SMC, I-00185 Rome, Italy
[2] Ecole Polytech Fed Lausanne, Inst Theoret Phys, IRRMA, Inst Romand Rech Numer Phys Mat, CH-1015 Lausanne, Switzerland
关键词
D O I
10.1088/0953-8984/19/25/256207
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
We numerically calculate the configurational entropy S-conf of a binary mixture of hard spheres, by using a perturbed Hamiltonian method trapping the system inside a given state, which requires fewer assumptions than the previous methods (Speedy 1998 Mol. Phys. 95 169). We find that Sconf is a decreasing function of the packing fraction. and extrapolates to zero at the Kauzmann packing fraction phi K similar or equal to 0.62, suggesting the possibility of an ideal glass transition for the hard-sphere system. Finally, the Adam-Gibbs relation is found to hold.
引用
收藏
页数:9
相关论文
共 50 条
  • [31] Estimates of the configurational entropy of a liquid
    Speedy, RJ
    JOURNAL OF PHYSICAL CHEMISTRY B, 2001, 105 (47): : 11737 - 11742
  • [32] CONFIGURATIONAL ENTROPY OF TITANIUM MONOXIDE
    JOSTSONS, A
    JENKINS, AE
    JOURNAL OF PHYSICAL CHEMISTRY, 1969, 73 (03): : 749 - &
  • [33] The vibrational and configurational entropy of α-brass
    Benisek, Artur
    Dachs, Edgar
    Salihovic, Miralem
    Paunovic, Aleksandar
    Maier, Maria E.
    JOURNAL OF CHEMICAL THERMODYNAMICS, 2014, 71 : 126 - 132
  • [34] Configurational entropy of Wigner clusters
    Radzvilavicius, A.
    Anisimovas, E.
    JOURNAL OF PHYSICS-CONDENSED MATTER, 2011, 23 (07)
  • [35] Configurational entropy: an improvement of the quasiharmonic approximation using configurational temperature
    Nguyen, Phuong H.
    Derreumaux, Philippe
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2012, 14 (02) : 877 - 886
  • [36] Pressure and entropy of hard spheres in the weakly nonequilibrium heat-conduction steady state
    Humenyuk, Y. A.
    CONDENSED MATTER PHYSICS, 2016, 19 (04)
  • [37] Simulation of spatial correlations of impurity ions in solids using configurational entropy and the hard-sphere model
    V. M. Mikheev
    Physics of the Solid State, 2005, 47 : 1091 - 1099
  • [38] Entropy-stabilized oxides with medium configurational entropy
    Chen, Kepi
    Ma, Jinxu
    Wang, Hetong
    Li, Cuiwei
    An, Linan
    CERAMICS INTERNATIONAL, 2021, 47 (07) : 9979 - 9983
  • [39] Simulation of spatial correlations of impurity ions in solids using configurational entropy and the hard-sphere model
    Mikheev, VM
    PHYSICS OF THE SOLID STATE, 2005, 47 (06) : 1091 - 1099
  • [40] Polydisperse hard spheres at a hard wall
    Buzzacchi, M
    Pagonabarraga, I
    Wilding, NB
    JOURNAL OF CHEMICAL PHYSICS, 2004, 121 (22): : 11362 - 11373