Please use this identifier to cite or link to this item: https://doi.org/10.1063/1.1869496
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dc.titleContinuous configuration time-dependent self-consistent field method for polyatomic quantum dynamical problems
dc.contributor.authorZhang, D.H.
dc.contributor.authorBao, W.
dc.contributor.authorYang, M.
dc.contributor.authorLee, S.-Y.
dc.date.accessioned2014-06-23T05:34:55Z
dc.date.available2014-06-23T05:34:55Z
dc.date.issued2005
dc.identifier.citationZhang, D.H., Bao, W., Yang, M., Lee, S.-Y. (2005). Continuous configuration time-dependent self-consistent field method for polyatomic quantum dynamical problems. Journal of Chemical Physics 122 (9) : -. ScholarBank@NUS Repository. https://doi.org/10.1063/1.1869496
dc.identifier.issn00219606
dc.identifier.urihttp://scholarbank.nus.edu.sg/handle/10635/75810
dc.description.abstractA new continuous configuration time-dependent self-consistent field method has been developed to study polyatomic dynamical problems by using the discrete variable representation for the reaction system, and applied to a reaction system coupled to a bath. The method is very efficient because the equations involved are as simple as those in the traditional single configuration approach, and can account for the correlations between the reaction system and bath modes rather well.
dc.description.urihttp://libproxy1.nus.edu.sg/login?url=http://dx.doi.org/10.1063/1.1869496
dc.sourceScopus
dc.typeArticle
dc.contributor.departmentCOMPUTATIONAL SCIENCE
dc.contributor.departmentCHEMISTRY
dc.description.doi10.1063/1.1869496
dc.description.sourcetitleJournal of Chemical Physics
dc.description.volume122
dc.description.issue9
dc.description.page-
dc.description.codenJCPSA
dc.identifier.isiut000227483300001
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