Publisher’s Note: “Orientational ordering and phase behaviour of binary mixtures of hard spheres and hard spherocylinders” [J. Chem. Phys. 143, 044906 (2015)]

2015 ◽  
Vol 143 (18) ◽  
pp. 189904
Author(s):  
Liang Wu ◽  
Alexandr Malijevský ◽  
George Jackson ◽  
Erich A. Müller ◽  
Carlos Avendaño
Keyword(s):  
Binary Mixtures ◽  
Hard Spheres ◽  
Chem Phys ◽  
Phase Behaviour ◽  
Orientational Ordering ◽  
Hard Spherocylinders

scholarly journals Orientational ordering and phase behaviour of binary mixtures of hard spheres and hard spherocylinders

2015 ◽  
Vol 143 (4) ◽  
pp. 044906 ◽  
Author(s):  
Liang Wu ◽  
Alexandr Malijevský ◽  
George Jackson ◽  
Erich A. Müller ◽  
Carlos Avendaño
Keyword(s):  
Binary Mixtures ◽  
Hard Spheres ◽  
Phase Behaviour ◽  
Orientational Ordering ◽  
Hard Spherocylinders

A TWO-COMPONENT FLUID MIXTURE OF THE HARD SPHEROCYLINDERS

2011 ◽  
Vol 25 (02) ◽  
pp. 301-317 ◽  
Author(s):  
M. MORADI ◽  
R. KHORDAD
Keyword(s):  
Correlation Functions ◽  
Density Functional ◽  
Hard Spheres ◽  
Chem Phys ◽  
Nonspherical Particles ◽  
Fluid Mixture ◽  
Functional Theory ◽  
Fluid Mixtures ◽  
Hypernetted Chain ◽  
Hard Spherocylinders

We study a classical fluid mixture of nonspherical molecules. The components of the mixture are two kinds of the hard spherocylinders with different shape anisotropies L/D. Two different approaches are used to calculate the direct correlation functions (DCF) of this kind of fluids. First, we use a formalism based on the weighted density functional theory (WDFT), introduced by Chamoux and Perera [ J. Chem. Phys.104, 1493 (1996)]. Second, we describe a general approach solving the Percus–Yevick (PY) and the hypernetted chain integral equation numerically for the fluid mixtures of hard nonspherical particles. In the second approach, the pair, total, and DCF of binary molecular fluid mixtures can be calculated simultaneously whereas in the WDFT, the pair and the total correlation functions are calculated indirectly. The obtained correlation functions are compared using these two methods. The pressure of the fluid mixture is also calculated using the Fourier zero components of the DCFs and compared with the Monte Carlo simulation. Finally, the large and small shape anisotropy, are considered and the results are compared with the binary fluid mixture of hard ellipsoids and hard spheres. The results are fairly in agreement.

Critical consolute point in hard-sphere binary mixtures: Effect of the value of the eighth and higher virial coefficients on its location

2010 ◽  
Vol 75 (3) ◽  
pp. 359-369 ◽  
Author(s):  
Mariano López De Haro ◽  
Anatol Malijevský ◽  
Stanislav Labík
Keyword(s):  
Equation Of State ◽  
Binary Mixtures ◽  
Hard Sphere ◽  
Hard Spheres ◽  
Virial Coefficients ◽  
Fluid Mixture ◽  
Binary Fluid ◽  
Virial Series ◽  
Consolute Point ◽  
Critical Constants

Various truncations for the virial series of a binary fluid mixture of additive hard spheres are used to analyze the location of the critical consolute point of this system for different size asymmetries. The effect of uncertainties in the values of the eighth virial coefficients on the resulting critical constants is assessed. It is also shown that a replacement of the exact virial coefficients in lieu of the corresponding coefficients in the virial expansion of the analytical Boublík–Mansoori–Carnahan–Starling–Leland equation of state, which still leads to an analytical equation of state, may lead to a critical consolute point in the system.

Note: Depletion potentials in non-additive asymmetric binary mixtures of hard-spheres

2014 ◽  
Vol 140 (2) ◽  
pp. 026101 ◽  
Author(s):  
César D. Estrada-Alvarez ◽  
Erik López-Sánchez ◽  
Gabriel Pérez-Ángel ◽  
Pedro González-Mozuelos ◽  
José Miguel Méndez-Alcaraz ◽  
...  
Keyword(s):  
Binary Mixtures ◽  
Hard Spheres

scholarly journals Peculiarities in the high-pressure phase behaviour of binary mixtures of nitrogen with methane, helium and water

1994 ◽  
Vol 6 (23A) ◽  
pp. A187-A192 ◽  
Author(s):  
J A Schouten ◽  
M G E van Hinsberg ◽  
M I M Scheerboom ◽  
J P J Michels
Keyword(s):  
High Pressure ◽  
Binary Mixtures ◽  
Phase Behaviour ◽  
High Pressure Phase ◽  
Pressure Phase

scholarly journals A note on rattlers in amorphous packings of binary mixtures of hard spheres

2010 ◽  
Vol 132 (17) ◽  
pp. 176101 ◽  
Author(s):  
I. Biazzo ◽  
F. Caltagirone ◽  
G. Parisi ◽  
F. Zamponi
Keyword(s):  
Binary Mixtures ◽  
Hard Spheres
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