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Neiss, Christian, Hättig, Christof, Klopper, Wim (2006) Extensions of r12 corrections to CC2-R12 for excited states. The Journal of Chemical Physics, 125 (6). 64111pp. doi:10.1063/1.2335443

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Reference TypeJournal (article/letter/editorial)
TitleExtensions of r12 corrections to CC2-R12 for excited states
JournalThe Journal of Chemical Physics
AuthorsNeiss, ChristianAuthor
Hättig, ChristofAuthor
Klopper, WimAuthor
Year2006 (August 14)Volume125
Issue6
PublisherAIP Publishing
DOIdoi:10.1063/1.2335443Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID2309146Long-form Identifiermindat:1:5:2309146:7
GUID0
Full ReferenceNeiss, Christian, Hättig, Christof, Klopper, Wim (2006) Extensions of r12 corrections to CC2-R12 for excited states. The Journal of Chemical Physics, 125 (6). 64111pp. doi:10.1063/1.2335443
Plain TextNeiss, Christian, Hättig, Christof, Klopper, Wim (2006) Extensions of r12 corrections to CC2-R12 for excited states. The Journal of Chemical Physics, 125 (6). 64111pp. doi:10.1063/1.2335443
In(2006, August) The Journal of Chemical Physics Vol. 125 (6) AIP Publishing

See Also

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Fliegl, Heike, Hättig, Christof, Klopper, Wim (2006) Coupled-cluster response theory with linear-r12 corrections: The CC2-R12 model for excitation energies. The Journal of Chemical Physics, 124 (4). 44112pp. doi:10.1063/1.2161183
Fliegl, Heike, Klopper, Wim, Hättig, Christof (2005) Coupled-cluster theory with simplified linear-r12 corrections: The CCSD(R12) model. The Journal of Chemical Physics, 122 (8). 84107pp. doi:10.1063/1.1850094
Neiss, Christian, Hättig, Christof (2007) Frequency-dependent nonlinear optical properties with explicitly correlated coupled-cluster response theory using the CCSD(R12) model. The Journal of Chemical Physics, 126 (15). 154101pp. doi:10.1063/1.2716662
Yang, Jun, Hättig, Christof (2009) Structures and harmonic vibrational frequencies for excited states of diatomic molecules with CCSD(R12) and CCSD(F12) models. The Journal of Chemical Physics, 130 (12). 124101pp. doi:10.1063/1.3093947
Tew, David P., Klopper, Wim, Neiss, Christian, Hättig, Christof (2008) Comment on Quintuple-ζ quality coupled-cluster correlation energies with triple-ζ basis sets by D. P. Tew, W. Klopper, C. Neiss and C. Hättig, Phys. Chem. Chem. Phys., 2007, 9, 1921 [erratum]. Physical Chemistry Chemical Physics, 10 (41). 6325pp. doi:10.1039/b811567b
Bischoff, Florian A., Valeev, Edward F., Klopper, Wim, Janssen, Curtis L. (2010) Scalar relativistic explicitly correlated R12 methods. The Journal of Chemical Physics, 132 (21). 214104pp. doi:10.1063/1.3417984
Winter, Nina O. C., Hättig, Christof (2011) Scaled opposite-spin CC2 for ground and excited states with fourth order scaling computational costs. The Journal of Chemical Physics, 134 (18). 184101pp. doi:10.1063/1.3584177
Jaszuński, Michał, Klopper, Wim, Noga, Jozef (2000) Explicitly correlated coupled cluster R12 calculations of the dipole polarizability of He2. The Journal of Chemical Physics, 113 (1). 71-72 doi:10.1063/1.481775
Köhn, Andreas, Hättig, Christof (2003) Analytic gradients for excited states in the coupled-cluster model CC2 employing the resolution-of-the-identity approximation. The Journal of Chemical Physics, 119 (10). 5021-5036 doi:10.1063/1.1597635
Klopper, Wim (2004) A hybrid scheme for the resolution-of-the-identity approximation in second-order Møller–Plesset linear-r12 perturbation theory. The Journal of Chemical Physics, 120 (23). 10890-10895 doi:10.1063/1.1742904
Yang, Jun, Hättig, Christof (2009) Highly accurate CCSD(R12) and CCSD(F12) optical response properties using standard triple-ζ basis sets. The Journal of Chemical Physics, 131 (7). 74102pp. doi:10.1063/1.3204388
 
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