Please use this identifier to cite or link to this item: https://doi.org/10.1023/B:CJOP.0000042647.51651.2a
DC FieldValue
dc.titleConnection between the 2-body energy of the Kaxiras-Pandey and the Biswas-Hamann potentials
dc.contributor.authorLim, T.-C.
dc.date.accessioned2014-11-28T06:33:09Z
dc.date.available2014-11-28T06:33:09Z
dc.date.issued2004-09
dc.identifier.citationLim, T.-C. (2004-09). Connection between the 2-body energy of the Kaxiras-Pandey and the Biswas-Hamann potentials. Czechoslovak Journal of Physics 54 (9) : 947-963. ScholarBank@NUS Repository. https://doi.org/10.1023/B:CJOP.0000042647.51651.2a
dc.identifier.issn00114626
dc.identifier.urihttp://scholarbank.nus.edu.sg/handle/10635/112588
dc.description.abstractRelationship among interatomic potential functions can be useful in shedding insight on the extent of similarity, and in obtaining a potential function from parameters of another potential function. The 2-body portion of the Biswas-Hamann (BH) and the Kaxiras-Pandey (KP) potential functions are related by equating both functions, as well as their corresponding derivatives up to the third order at the equilibrium bond length. Validity of the parametric relationship is verified by plotting the loose form of the 2-body BH potential in terms of KP parameters and comparing it with the KP potential function. The parametric relationships developed herein are then compared with those that concern other potential functions, with particular emphasis on the scaling factors.
dc.description.urihttp://libproxy1.nus.edu.sg/login?url=http://dx.doi.org/10.1023/B:CJOP.0000042647.51651.2a
dc.sourceScopus
dc.subjectanalytical method
dc.subjectcondensed matter
dc.subjectempirical potential functions
dc.subjectparametric relationship
dc.typeArticle
dc.contributor.departmentNUS NANOSCIENCE & NANOTECH INITIATIVE
dc.description.doi10.1023/B:CJOP.0000042647.51651.2a
dc.description.sourcetitleCzechoslovak Journal of Physics
dc.description.volume54
dc.description.issue9
dc.description.page947-963
dc.identifier.isiut000224691600006
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