Configurational temperature: Verification of Monte Carlo simulations

Journal of Chemical Physics

Volumn 109, Issue 16, 1998, Pages 6519-6522

  Butler, B D ^a   Ayton, Gary ^b   Jepps, Owen G ^b   Evans, Denis J ^b  

^a NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY   (United States)

^b AUSTRALIAN NATIONAL UNIVERSITY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 22244491267     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.477301     Document Type: Article

References (5)

1. H. H. Rugh, Phys. Rev. Lett. 78, 772 (1997);
2. " A geometric, dynamical approach to thermodynamics, " http://xxx.lanl.gov/abs/ chao-dyn/9703013 (1997).
3. G. A. Ayton, O. G. Jepps, and D. J. Evans, Mol. Phys. (in press).
4. See, for example, M. P. Allen and D. J. Tildesley, Computer Simulation of Liquids (Clarendon, Oxford, 1987), pp. 110-123.
5. We note here that the expressions commonly used to calculate all thermodynamic properties, such as the pressure, free energy, etc., are also only accurate to first order in N (see Ref. 3).