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Volumn 124, Issue 4, 2006, Pages

Coupled-cluster response theory with linear-r 12 corrections: The CC2-R12 model for excitation energies

Author keywords

[No Author keywords available]

Indexed keywords

COUPLED-CLUSTER RESPONSE THEORY; EXCITATION ENERGIES; LINEAR-R 12 CORRECTIONS; ORTHONORMAL AUXILIARY BASIS;

EID: 31544446900     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2161183     Document Type: Article
Times cited : (50)

References (51)
  • 19
    • 0000365617 scopus 로고    scopus 로고
    • Reviews of Current Trends Vol. edited by J.Leszczynski (World Scientific, Singapore
    • J. Noga and P. Valiron, in Computational Chemistry, Reviews of Current Trends Vol. 7, edited by, J. Leszczynski, (World Scientific, Singapore, 2002), pp. 131-185.
    • (2002) Computational Chemistry , vol.7 , pp. 131-185
    • Noga, J.1    Valiron, P.2
  • 21
    • 0035425521 scopus 로고    scopus 로고
    • 0021-9606 10.1063/1.1384011
    • J. Noga, P. Valiron, and W. Klopper, J. Chem. Phys. 0021-9606 10.1063/1.1384011 115, 2022 (2001); J. Noga, P. Valiron, and W. Klopper, J. Chem. Phys. 117, 2989 (2002).
    • (2001) J. Chem. Phys. , vol.115 , pp. 2022
    • Noga, J.1    Valiron, P.2    Klopper, W.3
  • 22
    • 0037043917 scopus 로고    scopus 로고
    • J. Noga, P. Valiron, and W. Klopper, J. Chem. Phys. 0021-9606 10.1063/1.1384011 115, 2022 (2001); J. Noga, P. Valiron, and W. Klopper, J. Chem. Phys. 117, 2989 (2002).
    • (2002) J. Chem. Phys. , vol.117 , pp. 2989
    • Noga, J.1    Valiron, P.2    Klopper, W.3
  • 40
    • 31544455944 scopus 로고    scopus 로고
    • C. Angeli, K. L. Bak, V. Bakken, Release 2.0, a molecular electronic structure program, 2005; DALTON, see http://www.kjemi.uio.no/software/dalton/ dalton.html
    • (2005)
    • Angeli, C.1    Bak, K.L.2    Bakken, V.3
  • 41
    • 84856125939 scopus 로고    scopus 로고
    • C. Angeli, K. L. Bak, V. Bakken, Release 2.0, a molecular electronic structure program, 2005; DALTON, see http://www.kjemi.uio.no/software/dalton/ dalton.html
  • 48
    • 31544436158 scopus 로고    scopus 로고
    • RBH =123.24 pm, RNN =109.76 pm, RCO =112.83 pm, and RBF =126.25 pm.
    • K. P. Huber and G. H. Herzberg, Constants of Diatomic Molecules (Van Nostrand-Reinhold, New York, 1979); RBH =123.24 pm, RNN =109.76 pm, RCO =112.83 pm, and RBF =126.25 pm.
  • 51
    • 31544481721 scopus 로고    scopus 로고
    • C. Neiss (private communication).
    • Neiss, C.1


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