메뉴 건너뛰기




Volumn 77, Issue 1, 2008, Pages

Theoretical study of molecular electronic excitations and optical transitions of C60

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION SPECTRA; EXCITED STATES; FULLERENES; MOLECULAR INTERACTIONS; MOLECULAR ORBITALS; OPTICAL TRANSITIONS; POLARIZATION;

EID: 40749130050     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.77.012503     Document Type: Article
Times cited : (16)

References (39)
  • 3
    • 0034719631 scopus 로고    scopus 로고
    • PYLAAG 0375-9601 10.1016/S0375-9601(00)00142-0
    • B. N. Plakhutin and R. Carbó-Dorca, Phys. Lett. A PYLAAG 0375-9601 10.1016/S0375-9601(00)00142-0 267, 370 (2000).
    • (2000) Phys. Lett. A , vol.267 , pp. 370
    • Plakhutin, B.N.1    Carbó-Dorca, R.2
  • 4
    • 0000117741 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.82.3224
    • E. Lo and B. R. Judd, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.82.3224 82, 3224 (1999)
    • (1999) Phys. Rev. Lett. , vol.82 , pp. 3224
    • Lo, E.1    Judd, B.R.2
  • 5
    • 0000774609 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.479916
    • B. R. Judd and E. Lo, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.479916 111, 5706 (1999).
    • (1999) J. Chem. Phys. , vol.111 , pp. 5706
    • Judd, B.R.1    Lo, E.2
  • 6
    • 0037044160 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1497644
    • A. V. Nikolaev and K. H. Michel, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1497644 117, 4761 (2002).
    • (2002) J. Chem. Phys. , vol.117 , pp. 4761
    • Nikolaev, A.V.1    Michel, K.H.2
  • 8
    • 45949117044 scopus 로고
    • CHPLBC 0009-2614 10.1016/0009-2614(87)80618-8
    • S. Larsson, A. Volosov, and A. Rosén, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(87)80618-8 137, 501 (1987).
    • (1987) Chem. Phys. Lett. , vol.137 , pp. 501
    • Larsson, S.1    Volosov, A.2    Rosén, A.3
  • 9
    • 0002748721 scopus 로고
    • CHPLBC 0009-2614 10.1016/0009-2614(88)87084-2
    • F. Negri, G. Orlandi, and F. Zerbetto, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(88)87084-2 144, 31 (1988).
    • (1988) Chem. Phys. Lett. , vol.144 , pp. 31
    • Negri, F.1    Orlandi, G.2    Zerbetto, F.3
  • 11
    • 45949116325 scopus 로고
    • CHPLBC 0009-2614 10.1016/0009-2614(87)80278-6
    • I. László and L. Udvardi, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(87)80278-6 136, 418 (1987).
    • (1987) Chem. Phys. Lett. , vol.136 , pp. 418
    • László, I.1    Udvardi, L.2
  • 18
    • 37049067337 scopus 로고
    • JMACEP 0959-9428 10.1039/jm9950501515
    • K. Tanigaki and K. Prassides, J. Mater. Chem. JMACEP 0959-9428 10.1039/jm9950501515 5, 1515 (1995).
    • (1995) J. Mater. Chem. , vol.5 , pp. 1515
    • Tanigaki, K.1    Prassides, K.2
  • 19
    • 0343807315 scopus 로고    scopus 로고
    • RPPHAG 0034-4885 10.1088/0034-4885/64/5/202
    • L. Forró and L. Mihály, Rep. Prog. Phys. RPPHAG 0034-4885 10.1088/0034-4885/64/5/202 64, 649 (2001).
    • (2001) Rep. Prog. Phys. , vol.64 , pp. 649
    • Forró, L.1    Mihály, L.2
  • 21
    • 0001177596 scopus 로고
    • CMPHC2 0301-0104 10.1016/0301-0104(80)80045-0
    • B. O. Roos and P. R. Taylor, Chem. Phys. CMPHC2 0301-0104 10.1016/0301-0104(80)80045-0 48, 157 (1980)
    • (1980) Chem. Phys. , vol.48 , pp. 157
    • Roos, B.O.1    Taylor, P.R.2
  • 23
    • 0000697781 scopus 로고    scopus 로고
    • CHPLBC 0009-2614 10.1016/S0009-2614(00)00839-3
    • J. C. Greer, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(00) 00839-3 326, 567 (2000).
    • (2000) Chem. Phys. Lett. , vol.326 , pp. 567
    • Greer, J.C.1
  • 27
    • 23444451420 scopus 로고    scopus 로고
    • The RHF code is a part of our original ALGOQMT package, which includes also the ALGOCI program. Examples of some calculations with the ALGORHF code are given in JCPSA6 0021-9606 10.1063/1.1947193
    • The RHF code is a part of our original ALGOQMT package, which includes also the ALGOCI program. Examples of some calculations with the ALGORHF code are given in A. Artemyev, A. Bibikov, V. Zayets, and I. Bodrenko, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1947193 123, 024103 (2005).
    • (2005) J. Chem. Phys. , vol.123 , pp. 024103
    • Artemyev, A.1    Bibikov, A.2    Zayets, V.3    Bodrenko, I.4
  • 30
    • 40749102461 scopus 로고    scopus 로고
    • Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 02/02/06 (EMSL)
    • Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 02/02/06 (EMSL), http://www.emsl.pnl. gov/forms/basisform.html
  • 31
    • 33746614482 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.456153
    • T. H. Dunning, Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.456153 90, 1007 (1989).
    • (1989) J. Chem. Phys. , vol.90 , pp. 1007
    • Dunning Jr, T.H.1
  • 37
    • 0001244456 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.460155
    • A. Hiraya and K. Shobatake, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.460155 94, 7700 (1991).
    • (1991) J. Chem. Phys. , vol.94 , pp. 7700
    • Hiraya, A.1    Shobatake, K.2
  • 39
    • 36849114280 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1672424
    • J. P. Doering, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1672424 51, 2866 (1969).
    • (1969) J. Chem. Phys. , vol.51 , pp. 2866
    • Doering, J.P.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.