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  • The objective of this paper is to provide an overview of various multi-reference (MR)coupled-cluster (CC) approaches, particularly those relating to our own research. Although MR CC methods have been around for almost three decades and much work has been expended on their develoment and implementation, no general purpose codes are presently available. In view of the complexity, inherent difficulties, and computational demands of both genuine valence and state universal (VU and SU) MR CC methods, attention has been directed towards the state selective os rtate specific (SS) approaches that focus on one stateat a time. These methods are based on either the genuine MR CC formalism or on a single-reference (SR) CC Ansatz, in which higher-than-pair clusters are accounted for by relying on basic ideas of general MR approaches.
  • The objective of this paper is to provide an overview of various multi-reference (MR)coupled-cluster (CC) approaches, particularly those relating to our own research. Although MR CC methods have been around for almost three decades and much work has been expended on their develoment and implementation, no general purpose codes are presently available. In view of the complexity, inherent difficulties, and computational demands of both genuine valence and state universal (VU and SU) MR CC methods, attention has been directed towards the state selective os rtate specific (SS) approaches that focus on one stateat a time. These methods are based on either the genuine MR CC formalism or on a single-reference (SR) CC Ansatz, in which higher-than-pair clusters are accounted for by relying on basic ideas of general MR approaches. (en)
Title
  • Multireference Coupled-Cluster Methods: Recent Developments
  • Multireference Coupled-Cluster Methods: Recent Developments (en)
skos:prefLabel
  • Multireference Coupled-Cluster Methods: Recent Developments
  • Multireference Coupled-Cluster Methods: Recent Developments (en)
skos:notation
  • RIV/61388955:_____/10:00346314!RIV11-GA0-61388955
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(GA203/07/0070), Z(AV0Z40400503)
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
http://linked.open.../riv/druhVysledku
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http://linked.open...titaPredkladatele
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  • 273189
http://linked.open...ai/riv/idVysledku
  • RIV/61388955:_____/10:00346314
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • Hilbert space; multireference coupled cluster; Brillouin-Wigner coupled cluster (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...ontrolniKodProRIV
  • [25C991EF95DF]
http://linked.open...i/riv/mistoVydani
  • Dordrecht
http://linked.open...vEdiceCisloSvazku
  • Challenges and Advances in Comput. Chem. Phys., 11
http://linked.open...i/riv/nazevZdroje
  • Recent Progress in Coupled Cluster Methods. Theorey and Applications
http://linked.open...in/vavai/riv/obor
http://linked.open...ichTvurcuVysledku
http://linked.open...v/pocetStranKnihy
http://linked.open...cetTvurcuVysledku
http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...iv/tvurceVysledku
  • Pittner, Jiří
  • Paldus, J.
  • Čársky, Petr
http://linked.open...n/vavai/riv/zamer
number of pages
http://purl.org/ne...btex#hasPublisher
  • Springer-Verlag
https://schema.org/isbn
  • 978-90-481-2884-6
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