ESTIMATION OF SECOND VIRIAL COEFFICIENTS FOR RARE GASES IN THERMODYNAMIC VIEWS

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BAGHERNEJAD M.; ZARE K.

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Paper Information

Journal: JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY Year:2013 | Volume:10 | Issue:2 Page(s): 107-115

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Information Journal Paper

Title

ESTIMATION OF SECOND VIRIAL COEFFICIENTS FOR RARE GASES IN THERMODYNAMIC VIEWS

Author(s)

BAGHERNEJAD M. | ZARE K. | Issue Writer Certificate

Keywords

RARE GASESQ2

LENNARD-JONES POTENTIALQ2

VIRIAL COEFFICIENTQ2

Abstract

Using the Gaussian 2003 software and MP2/ 6–311++G** method for He: He, Ne: Ne and MP2/6-31G method for Ar: Ar, Kr: Kr and HF/STO-3G method for Xe: Xe, the optimized interaction energies between two like atoms of RARE GASES (He, Ne, Ar, Kr and Xe) as a function of the distances between the centers of two considered atoms were evaluated and the results were interpreted according to the Lennard-Jones equation. In addition, the second VIRIAL COEFFICIENT of each rare gas was calculated upon the appropriate equations of statistical thermodynamics. The resultent coefficients were comparable with those are available in the literature.

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APA: Copy

BAGHERNEJAD, M., & ZARE, K.. (2013). ESTIMATION OF SECOND VIRIAL COEFFICIENTS FOR RARE GASES IN THERMODYNAMIC VIEWS. JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY, 10(2), 107-115. SID. https://sid.ir/paper/207690/en

Vancouver: Copy

BAGHERNEJAD M., ZARE K.. ESTIMATION OF SECOND VIRIAL COEFFICIENTS FOR RARE GASES IN THERMODYNAMIC VIEWS. JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY[Internet]. 2013;10(2):107-115. Available from: https://sid.ir/paper/207690/en

IEEE: Copy

M. BAGHERNEJAD, and K. ZARE, “ESTIMATION OF SECOND VIRIAL COEFFICIENTS FOR RARE GASES IN THERMODYNAMIC VIEWS,” JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY, vol. 10, no. 2, pp. 107–115, 2013, [Online]. Available: https://sid.ir/paper/207690/en

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