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Volumn 129, Issue 13, 2008, Pages

Method specific Cholesky decomposition: Coulomb and exchange energies

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; PROBABILITY DENSITY FUNCTION;

EID: 53449086990     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2988315     Document Type: Article
Times cited : (66)

References (41)
  • 3
    • 0031285839 scopus 로고    scopus 로고
    • TCHAAM 0040-5744 10.1007/s002140050269.
    • F. Weigend and M. Häser, Theor. Chim. Acta TCHAAM 0040-5744 10.1007/s002140050269 97, 331 (1997).
    • (1997) Theor. Chim. Acta , vol.97 , pp. 331
    • Weigend, F.1    Häser, M.2
  • 4
    • 0037154597 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1445115.
    • F. Weigend, A. Köhn, and C. Hättig, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1445115 116, 3175 (2002).
    • (2002) J. Chem. Phys. , vol.116 , pp. 3175
    • Weigend, F.1    Köhn, A.2    Hättig, C.3
  • 7
    • 35248882601 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.2794036.
    • D. Yamaki, H. Koch, and S. Ten-no, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2794036 127, 144104 (2007).
    • (2007) J. Chem. Phys. , vol.127 , pp. 144104
    • Yamaki, D.1    Koch, H.2    Ten-No, S.3
  • 10
    • 0038809155 scopus 로고
    • CHPLBC 0009-2614 10.1016/0009-2614(86)80099-9.
    • I. Røeggen and E. Wisløff-Nilssen, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(86)80099-9 132, 154 (1986).
    • (1986) Chem. Phys. Lett. , vol.132 , pp. 154
    • Røeggen, I.1    Wisløff-Nilssen, E.2
  • 11
    • 84990655583 scopus 로고
    • IJQCB2 0020-7608 10.1002/qua.560360602.
    • D. W. O'Neal and J. Simons, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/qua.560360602 36, 673 (1989).
    • (1989) Int. J. Quantum Chem. , vol.36 , pp. 673
    • O'Neal, D.W.1    Simons, J.2
  • 13
    • 33644656860 scopus 로고    scopus 로고
    • a molecular electronic structure program
    • DALTON, Release 2.0, a molecular electronic structure program, 2005 (see http://www.kjemi.uio.no/software/dalton/dalton.html).
    • (2005) DALTON, Release 2.0
  • 20
    • 53449097875 scopus 로고    scopus 로고
    • University of Lund, Sweden
    • MOLCAS 6, University of Lund, Sweden, 2005 (see http://www.teokem.lu.se/ molcas/).
    • (2005) MOLCAS , vol.6
  • 22
    • 44349116060 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.2925269.
    • I. Røeggen and T. Johansen, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2925269 128, 194107 (2008).
    • (2008) J. Chem. Phys. , vol.128 , pp. 194107
    • Røeggen, I.1    Johansen, T.2
  • 25
  • 26
    • 0000737141 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1701483.
    • P. O. Löwdin, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1701483 43, S175 (1965).
    • (1965) J. Chem. Phys. , vol.43 , pp. 175
    • Löwdin, P.O.1
  • 28
    • 36849099978 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1679012.
    • J. L. Whitten, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1679012 58, 4496 (1973).
    • (1973) J. Chem. Phys. , vol.58 , pp. 4496
    • Whitten, J.L.1
  • 36
    • 53449092057 scopus 로고    scopus 로고
    • L. Boman, H. Koch, and A. Sánchez de Merás (to be published)
    • L. Boman, H. Koch, and A. Sánchez de Merás (to be published).
  • 38
    • 4243702919 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.6.596.
    • A. F. Schuch and R. L. Mills, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.6.596 6, 596 (1961).
    • (1961) Phys. Rev. Lett. , vol.6 , pp. 596
    • Schuch, A.F.1    Mills, R.L.2
  • 41
    • 5744249665 scopus 로고    scopus 로고
    • CHPLBC 0009-2614 10.1016/j.cplett.2004.09.041.
    • S. Ten-no, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/j.cplett.2004.09. 041 398, 56 (2004).
    • (2004) Chem. Phys. Lett. , vol.398 , pp. 56
    • Ten-No, S.1


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