Research Article

Modified Lennard-Jones Potentials with a Reduced Temperature-Correction Parameter for Calculating Thermodynamic and Transport Properties: Noble Gases and Their Mixtures (He, Ne, Ar, Kr, and Xe)

Table 6

Deviations between experimental and predicted second cross-virial coefficients of noble gas mixtures.

MixturesNumber of pointsAverage RMSD in (cm3 mol−1) (K) Reference
Present studyL-JDymond et al.Tsonopoulos

Mixtures of noble gases

Helium-neon182.055.820.949.4015–323[2]
230.660.541.7210.6273–3273[26]
Helium-argon212.030.920.446.8590–773[2]
234.905.716.3714.8273–3273[26]
Helium-krypton155.663.490.991.8490–323[2]
238.5412.012.015.9273–3273[26]
Helium-xenon910.96.070.717.14120–323[2]
2315.819.723.321.5273–3273[26]

Average 155* 6.15 7.12 6.75 11.9

Neon-argon301.6834.91.007.7284–475[2]
233.151.156.694.71273–3273[26]
Neon-krypton485.1548.62.7614.3100–475[2]
233.863.298.076.69273–3273[26]
Neon-xenon2816.539.42.6117.6162–475[2]
2310.87.3618.912.5273–3273[26]

Average 175* 6.68 27.2 5.77 11.2

Argon-krypton503.26150.3
1.822.51108–695[2]
231.5816.72.934.53273–3273[26]
Argon-xenon512.3125.50.2912.1173–323[2]
234.6023.930.05.76273–3273[26]

Average 101* 3.63 89.9 8.43 4.18

Krypton-xenon357.34173.71.975.76160–700[2]
232.3442.63.404.44273–3273[26]

Average 58* 5.36 121.7 2.54 5.24

Overall489**5.7345.06.259.28

Number of data points for each gas mixture. Total number of data points for all gas mixtures.