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Volumn 132, Issue 2, 2010, Pages

Communications: Explicitly correlated equation-of-motion coupled cluster method for ionized states

Author keywords

[No Author keywords available]

Indexed keywords

COMPLETE BASIS SET LIMIT; COUPLED-CLUSTER METHODS; COUPLED-CLUSTER SINGLES AND DOUBLES; IONIZED STATE; NUMERICAL TESTS;

EID: 74549115191     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3291042     Document Type: Article
Times cited : (19)

References (32)
  • 2
    • 0037091216 scopus 로고    scopus 로고
    • Explicitly correlated second-order Møller-Plesset methods with auxiliary basis sets
    • DOI 10.1063/1.1461814
    • W. Klopper and C. C. M. Samson, J. Chem. Phys. 0021-9606 116, 6397 (2002). 10.1063/1.1461814 (Pubitemid 34460115)
    • (2002) Journal of Chemical Physics , vol.116 , Issue.15 , pp. 6397-6410
    • Klopper, W.1    Samson, C.C.M.2
  • 3
    • 4444367231 scopus 로고    scopus 로고
    • 0009-2614,. 10.1016/j.cplett.2004.07.061
    • E. F. Valeev, Chem. Phys. Lett. 0009-2614 395, 190 (2004). 10.1016/j.cplett.2004.07.061
    • (2004) Chem. Phys. Lett. , vol.395 , pp. 190
    • Valeev, E.F.1
  • 4
    • 3142707293 scopus 로고    scopus 로고
    • 0021-9606,. 10.1063/1.1757439
    • S. Ten-no, J. Chem. Phys. 0021-9606 121, 117 (2004). 10.1063/1.1757439
    • (2004) J. Chem. Phys. , vol.121 , pp. 117
    • Ten-No, S.1
  • 5
    • 5744249665 scopus 로고    scopus 로고
    • 0009-2614,. 10.1016/j.cplett.2004.09.041
    • S. Ten-no, Chem. Phys. Lett. 0009-2614 398, 56 (2004). 10.1016/j.cplett.2004.09.041
    • (2004) Chem. Phys. Lett. , vol.398 , pp. 56
    • Ten-No, S.1
  • 7
    • 36449003616 scopus 로고
    • 0021-9606,. 10.1063/1.468266
    • J. Noga and W. Kutzelnigg, J. Chem. Phys. 0021-9606 101, 7738 (1994). 10.1063/1.468266
    • (1994) J. Chem. Phys. , vol.101 , pp. 7738
    • Noga, J.1    Kutzelnigg, W.2
  • 8
    • 43149101630 scopus 로고    scopus 로고
    • Explicitly correlated coupled cluster F12 theory with single and double excitations
    • DOI 10.1063/1.2907741
    • J. Noga, S. Kedžuch, J. Šimunek, and S. Ten-no, J. Chem. Phys. 0021-9606 128, 174103 (2008). 10.1063/1.2907741 (Pubitemid 351644878)
    • (2008) Journal of Chemical Physics , vol.128 , Issue.17 , pp. 174103
    • Noga, J.1    Kedzuch, S.2    Simunek, J.3    Ten-No, S.4
  • 10
    • 37249022012 scopus 로고    scopus 로고
    • 1463-9076,. 10.1039/b713938a
    • E. F. Valeev, Phys. Chem. Chem. Phys. 1463-9076 10, 106 (2008). 10.1039/b713938a
    • (2008) Phys. Chem. Chem. Phys. , vol.10 , pp. 106
    • Valeev, E.F.1
  • 11
    • 37149036190 scopus 로고    scopus 로고
    • A simple and efficient CCSD(T)-F12 approximation
    • DOI 10.1063/1.2817618
    • T. B. Adler, G. Knizia, and H. -J. Werner, J. Chem. Phys. 0021-9606 127, 221106 (2007). 10.1063/1.2817618 (Pubitemid 350262191)
    • (2007) Journal of Chemical Physics , vol.127 , Issue.22 , pp. 221106
    • Adler, T.B.1    Knizia, G.2    Werner, H.-J.3
  • 12
    • 38949139426 scopus 로고    scopus 로고
    • 0009-2614,. 10.1016/j.cplett.2007.12.070
    • D. P. Tew, W. Klopper, and C. Hättig, Chem. Phys. Lett. 0009-2614 452, 326 (2008). 10.1016/j.cplett.2007.12.070
    • (2008) Chem. Phys. Lett. , vol.452 , pp. 326
    • Tew, D.P.1    Klopper, W.2    Hättig, C.3
  • 17
    • 64549093307 scopus 로고    scopus 로고
    • 0021-9606,. 10.1063/1.3116792
    • A. Köhn, J. Chem. Phys. 0021-9606 130, 131101 (2009). 10.1063/1.3116792
    • (2009) J. Chem. Phys. , vol.130 , pp. 131101
    • Köhn, A.1
  • 18
    • 62549157078 scopus 로고    scopus 로고
    • 0021-9606,. 10.1063/1.3079543
    • A. Köhn, J. Chem. Phys. 0021-9606 130, 104104 (2009). 10.1063/1.3079543
    • (2009) J. Chem. Phys. , vol.130 , pp. 104104
    • Köhn, A.1
  • 22
    • 26144450008 scopus 로고
    • 0009-2614 10.1016/0009-2614(93)89023-B
    • D. C. Comeau and R. J. Bartlett, Chem. Phys. Lett. 0009-2614 207, 414 (1993). 10.1016/0009-2614(93)89023-B
    • (1993) Chem. Phys. Lett. , vol.207 , pp. 414
    • Comeau, D.C.1    Bartlett, R.J.2
  • 24
  • 29
    • 33846108369 scopus 로고    scopus 로고
    • New implementation of second-order Møller-Plesset perturbation theory with an analytic Slater-type geminal
    • DOI 10.1063/1.2403853
    • S. Ten-no, J. Chem. Phys. 0021-9606 126, 014108 (2007). 10.1063/1.2403853 (Pubitemid 46068397)
    • (2007) Journal of Chemical Physics , vol.126 , Issue.1 , pp. 014108
    • Ten-No, S.1
  • 31
    • 74549197777 scopus 로고    scopus 로고
    • http://webbook.nist.gov
  • 32
    • 74549176724 scopus 로고    scopus 로고
    • See supplementary material at E-JCPSA6-132-017003 for explicit forms of some representative diagrams
    • See supplementary material at http://dx.doi.org/10.1063/1.3291042 E-JCPSA6-132-017003 for explicit forms of some representative diagrams.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.