Calculation of thermodynamic properties of liquid alkali metals by the first-principle-pseudopotential and Weeks-Chandler-Andersen methods

Doklady Physics

Volumn 58, Issue 8, 2013, Pages 339-342

  Krashaninin, V A ^a,b   Dubinin, N E ^a,b   Vatolin, N A ^a,b  

^a RUSSIAN ACADEMY OF SCIENCES   (Russian Federation)

^b URAL FEDERAL UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

CONDUCTION ELECTRONS; CORE ELECTRONS; ENERGY SHIFT; LIQUID ALKALI METALS; VARIATIONAL METHODS;

ALKALI METALS; ORDINARY DIFFERENTIAL EQUATIONS;

THERMODYNAMIC PROPERTIES;

EID: 84883894691     PISSN: 10283358     EISSN: None     Source Type: Journal    
DOI: 10.1134/S1028335813080144     Document Type: Article

References (15)

1. R. Kumaravadivel and R. Evans, J. Phys. C: Solid State Phys. 9, 3877 (1976).
2. A. M. Bratkovsky, V. S. Vaks, and A. V. Trefilov, J. Phys. F: Metal Phys. 13, 2517 (1983).
3. J. A. Moriarty, D. A. Young, and M. Ross, Phys. Rev. B 30, 578 (1984).
4. J. Hafner, The Electronic and Statistical-Mechanical Theory of s, p Bonded Metals and Alloys (Springer, Berlin, 1987).
5. N. E. Dubinin, A. A. Yuryev, and N. A. Vatolin, High Temp. Mater. Processes 14(4), 285 (1995).
6. N. E. Dubinin, A. A. Yuryev, and N. A. Vatolin, Thermochim. Acta 316, 123 (1998).
7. N. E. Dubinin, A. A. Yuryev, and N. A. Vatolin, Thermochim. Acta 518, 9 (2011).
8. V. A. Krashaninin, A. A. Yur'ev, and E. A. Yur'ev, Rasplavy, No. 4, 24 (2011).
9. J. D. Weeks, D. Chandler, and H. C. Andersen, J. Chem. Phys. 54, 5237 (1971).
10. V. A. Krashaninin, Dokl. Akad. Nauk 332(5), 595 (1993).
11. V. A. Krashaninin, Rasplavy, No. 4, 3 (1999).
12. V. E. Zinov'ev, Thermal Properties of Metals at High Temperatures (Metallurgiya, Moscow, 1989) [in Russian].
13. J. K. Percus and G. Y. Yevick, Phys. Rev. 110(1), 1 (1958).
14. M. S. Wertheim, Phys. Rev. Lett. 10, 321 (1963).
15. P. I. Bystrov, D. N. Kagan, G. A. Krechetova, and E. E. Shpil'rain, Liquid-Metal Heat Carriers of Thermal Pipes and Energy Installations (Nauka, Moscow, 1988) [in Russian].