View Item 

Show simple item record

Efficient determination of thermodynamic properties from a single simulation
dc.contributor.authorRickman, J. M.en_US
dc.contributor.authorSrolovitz, David J.en_US
dc.date.accessioned2010-05-06T21:10:02Z
dc.date.available2010-05-06T21:10:02Z
dc.date.issued1993-11-15en_US
dc.identifier.citationRickman, J. M.; Srolovitz, D. J. (1993). "Efficient determination of thermodynamic properties from a single simulation." The Journal of Chemical Physics 99(10): 7993-7997. <http://hdl.handle.net/2027.42/69798>en_US
dc.identifier.urihttps://hdl.handle.net/2027.42/69798
dc.description.abstractA method for calculating the density of states of a system directly from its trajectory in phase space is described. As a specific example, the method is applied to the Monte Carlo simulation of a two‐dimensional Ising model. The energy distribution function is calculated from the density of states and the associated Helmholtz free energy per spin is calculated for various system sizes and temperatures and shown to be in excellent agreement with the exact results.en_US
dc.format.extent3102 bytes
dc.format.extent615086 bytes
dc.format.mimetypetext/plain
dc.format.mimetypeapplication/pdf
dc.publisherThe American Institute of Physicsen_US
dc.rights© The American Institute of Physicsen_US
dc.titleEfficient determination of thermodynamic properties from a single simulationen_US
dc.typeArticleen_US
dc.subject.hlbsecondlevelPhysicsen_US
dc.subject.hlbtoplevelScienceen_US
dc.description.peerreviewedPeer Revieweden_US
dc.contributor.affiliationumDepartment of Materials Science and Engineering, The University of Michigan, Ann Arbor, Michigan 48109en_US
dc.description.bitstreamurlhttp://deepblue.lib.umich.edu/bitstream/2027.42/69798/2/JCPSA6-99-10-7993-1.pdf
dc.identifier.doi10.1063/1.465675en_US
dc.identifier.sourceThe Journal of Chemical Physicsen_US
dc.identifier.citedreferenceK. Binder, J. Comp. Phys. 59, 1 (1985).en_US
dc.identifier.citedreferenceD. Frenkel and A. J. C. Ladd, J. Chem. Phys. 81, 3188 (1984).en_US
dc.identifier.citedreferenceK. K. Mon, Phys. Rev. Lett. 54, 2671 (1985).en_US
dc.identifier.citedreferenceJ. Q. Broughton and X. P. Li, Phys. Rev. B 35, 9120 (1987).en_US
dc.identifier.citedreferenceS. R. Phillpot and J. M. Rickman, J. Chem. Phys. 94, 1454 (1991).en_US
dc.identifier.citedreferenceR. LeSar, R. Najafabadi. and D. J. Srolovitz, Phys. Rev. Lett. 63, 624 (1989).en_US
dc.identifier.citedreferenceS.-K. Ma, J. Stat. Phys. 26, 221 (1981).en_US
dc.identifier.citedreferenceS.-K. Ma and M. Payne, Phys. Rev. B 24, 3984 (1981).en_US
dc.identifier.citedreferenceI. R. MacDonald and K. Singer, Discuss. Faraday Soc. 43, 40 (1967); A. M. Ferrenberg and R. H. Swendsen, Phys. Rev. Lett. 61, 2635 (1988).en_US
dc.identifier.citedreferenceJ. M. Rickman and S. R. Phillpot, Phys. Rev. Lett. 66, 349 (1991).en_US
dc.identifier.citedreferenceG. Bhanot, R. Salvador, S. Black, P. Carter, and R. Toral, Phys. Rev. Lett. 59, 803 (1987).en_US
dc.identifier.citedreferenceL. Onsager, Phys. Rev. 65, 117 (1944); A. E. Ferdinand and M. E. Fisher, Phys. Rev. 185, 832 (1969).en_US
dc.identifier.citedreferenceS.-K. Ma, Statistical Mechanics (World Scientific, Philadelphia, 1985).en_US
dc.owningcollnamePhysics, Department of


Files in this item

Name:
JCPSA6-99-10-7993-1.pdf
Size:
600.6KB
Format:
PDF
View/Open

Show simple item record

Remediation of Harmful Language

The University of Michigan Library aims to describe library materials in a way that respects the people and communities who create, use, and are represented in our collections. Report harmful or offensive language in catalog records, finding aids, or elsewhere in our collections anonymously through our metadata feedback form. More information at Remediation of Harmful Language.

Accessibility

If you are unable to use this file in its current format, please select the Contact Us link and we can modify it to make it more accessible to you.