Efficient Implementation Of The Hellmann-feynman Theorem In A Diffusion Monte Carlo Calculation

dc.creatorVitiello S.A.
dc.date2011
dc.date2015-06-30T20:45:23Z
dc.date2015-11-26T14:54:44Z
dc.date2015-06-30T20:45:23Z
dc.date2015-11-26T14:54:44Z
dc.date.accessioned2018-03-28T22:06:43Z
dc.date.available2018-03-28T22:06:43Z
dc.identifier
dc.identifierJournal Of Chemical Physics. , v. 134, n. 5, p. - , 2011.
dc.identifier219606
dc.identifier10.1063/1.3532411
dc.identifierhttp://www.scopus.com/inward/record.url?eid=2-s2.0-79951547636&partnerID=40&md5=8ed14a3948d4b8e3c9d00e80849354df
dc.identifierhttp://www.repositorio.unicamp.br/handle/REPOSIP/109101
dc.identifierhttp://repositorio.unicamp.br/jspui/handle/REPOSIP/109101
dc.identifier2-s2.0-79951547636
dc.identifier.urihttp://repositorioslatinoamericanos.uchile.cl/handle/2250/1255206
dc.descriptionKinetic and potential energies of systems of 4He atoms in the solid phase are computed at T = 0. Results at two densities of the liquid phase are presented as well. Calculations are performed by the multiweight extension to the diffusion Monte Carlo method that allows the application of the Hellmann-Feynman theorem in a robust and efficient way. This is a general method that can be applied in other situations of interest as well. © 2011 American Institute of Physics.
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dc.languageen
dc.publisher
dc.relationJournal of Chemical Physics
dc.rightsaberto
dc.sourceScopus
dc.titleEfficient Implementation Of The Hellmann-feynman Theorem In A Diffusion Monte Carlo Calculation
dc.typeArtículos de revistas


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