نتایج جستجو برای: Effective pair potential

تعداد نتایج: 1765452  

Journal: :iranian journal of chemistry and chemical engineering (ijcce) 2003
gholamabbas parsafar zahra kalantar

in this work, we consider each normal alkane as a hypothetical mixtureof methyland methylene groups, in which the interaction potential of each pair is assumed to be the average effective pair potential. then, the lir equation of state (eos) is extended for such a hypothetical mixture. also, three basic compounds, namely, propane, n-butane and cyclohexane, are used to obtain the contribution of...

Journal: :iranian journal of chemistry and chemical engineering (ijcce) 2011
haniyeh alizadeh osgouei gholam abbas parsafar hamed akbarzadeh

in this paper the density and temperature dependencies of surface tension are investigated. using the lennard-jones (12,6), as an effective pair interaction potential, a linear expression is derived for isotherms of g /r2  versus r2 for some normal and chlorofluorocarbons (cfcs) fluids, where  is surface tension and r = 1/v is molar density. the linearity behavior of the derived equation is wel...

Journal: :Journal of Physics: Conference Series 2013

Gholamabbas Parsafar Zahra Kalantar

In this work, we consider each normal alkane as a hypothetical mixtureof methyland methylene groups, in which the interaction potential of each pair is assumed to be the average effective pair potential. Then, the LIR equation of state (EOS) is extended for such a hypothetical mixture. Also, three basic compounds, namely, propane, n-butane and cyclohexane, are used to obtain the contributio...

Journal: :Physical chemistry chemical physics : PCCP 2017
Guillaume Bareigts Christophe Labbez

Simulations of charged colloidal dispersions are technically challenging. One possible workaround consists in reducing the system to the colloids only, whose interactions are described through an effective pair potential, wf. Still, the determination of wf is difficult mainly because it depends on the colloidal density, ϕ. Here we propose to calculate wf from simulations of a pair of colloids p...

Journal: :physical chemistry and electrochemistry 0

in this study, a temperature-dependent of the dispersion coefficients is calculated from equation state.the lennard-jones lj (12-6-3) effective pair potential function and simple thermodynamic argumentwith the input pvt data of liquid metals are used to calculate the dispersion coefficients. the dispersioncoefficients ( , , ) 3 6 12 c c c are found to be a linear function of 1/t1+α , where t is...

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