Correlation for the second virial coefficient of water

被引：146

作者：

Harvey, AH ^{[1
]}

Lemmon, EW ^{[1
]}

机构：

[1] Natl Inst Stand & Technol, Phys & Chem Properties Div, Boulder, CO 80305 USA

来源：

JOURNAL OF PHYSICAL AND CHEMICAL REFERENCE DATA | 2004年 / 33卷 / 01期

关键词：

H2O; second virial coefficient; steam; thermodynamics; water;

D O I：

10.1063/1.1587731

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

A new correlation has been developed to represent the second virial coefficient of water (H2O) as a function of temperature. The formulation was fitted to experimental data, both for the second virial coefficient itself and for a quantity related to its first temperature derivative, at temperatures between approximately 310 and 1170 K. The high-temperature extrapolation behavior was guided by results calculated from a high-quality intermolecular pair potential. The new correlation agrees well with the experimental data deemed to be reliable, and at high temperatures is a significant improvement over the best previous formulation. (C) 2004 by the U.S. Secretary of Commerce on behalf of the United States. All rights reserved.

引用

页码：369 / 376

页数：8

共 29 条

[1] Second caloric virial coefficients for real gases and combined spherical symmetric potential for simple molecular interactions [J].

Abdulagatov, AI ;

Kaplun, AB ;

Meshalkin, AB ;

Abdulagatov, IM ;

Stepanov, GV .

JOURNAL OF CHEMICAL THERMODYNAMICS, 2002, 34 (12) :2049-2072

[2] Measurements of the (p,p,T) properties and virial coefficients of pure water, methane, n-hexane, n-octane, benzene, and of their aqueous mixtures in the supercritical region [J].

Abdulagatov, IM ;

Bazaev, AR ;

Gasanov, RK ;

Ramazanova, AE .

JOURNAL OF CHEMICAL THERMODYNAMICS, 1996, 28 (09) :1037-1057

[3] Development of transferable interaction models for water. III. Reparametrization of an all-atom polarizable rigid model (TTM2-R) from first principles [J].

Burnham, CJ ;

Xantheas, SS .

JOURNAL OF CHEMICAL PHYSICS, 2002, 116 (04) :1500-1510

[4] The heat capacity and pressure variation of the enthalpy for steam from 38 degrees to 125 degrees C Part V Steam research program [J].

Collins, SC ;

Keyes, FG .

PROCEEDINGS OF THE AMERICAN ACADEMY OF ARTS AND SCIENCES, 1938, 72 (3/10) :283-299

[5]

Cooper J. R., 1982, International Journal of Thermophysics, V3, P35, DOI 10.1007/BF00503957

[6]

ERTLE S, 1979, THESIS TU MUNCHEN GE

[7] EXPERIMENTAL DENSITIES AND VIRIAL-COEFFICIENTS FOR STEAM FROM 348 TO 498 K WITH CORRECTION FOR ADSORPTION EFFECTS [J].

EUBANK, PT ;

JOFFRION, LL ;

PATEL, MR ;

WAROWNY, W .

JOURNAL OF CHEMICAL THERMODYNAMICS, 1988, 20 (09) :1009-1034

[8] Spectroscopic determination of the water dimer intermolecular potential-energy surface [J].

Goldman, N ;

Fellers, RS ;

Brown, MG ;

Braly, LB ;

Keoshian, CJ ;

Leforestier, C ;

Saykally, RJ .

JOURNAL OF CHEMICAL PHYSICS, 2002, 116 (23) :10148-10163

[9]

HARVEY AH, 2000, STEAM WATER HYDROTHE, P571

[10] A new evaluation of (p, rho, T) measurements on steam with corrections for the effects of physical and chemical adsorption [J].

Hendl, H ;

Bich, E ;

Vogel, E .

JOURNAL OF CHEMICAL THERMODYNAMICS, 1997, 29 (07) :765-784

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