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Volumn 109, Issue 12, 1998, Pages 4960-4970

New expression for the effective transfer matrix element in long-range electron transfer reactions

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0000242204     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.477107     Document Type: Article
Times cited : (35)

References (27)
  • 12
    • 21544452215 scopus 로고    scopus 로고
    • note
    • The files containing the atomic coordinates of the modified azurin proteins were supplied by Ralf Langen of Gray's research group at the California Institute of Technology.
  • 20
    • 0004180672 scopus 로고
    • Frank J. Seiler Research Laboratory, United States Air Force Academy, Colorado MOPAC 6 code and manual were from Computation Chemistry List archive. The code was modified for this work
    • J. J. P. Stewart, MOPAC Manual, 6th ed. (Frank J. Seiler Research Laboratory, United States Air Force Academy, Colorado, 1990). MOPAC 6 code and manual were from Computation Chemistry List archive. The code was modified for this work.
    • (1990) MOPAC Manual, 6th ed.
    • Stewart, J.J.P.1
  • 23
    • 21544432402 scopus 로고    scopus 로고
    • Digital Equipment Corp. contains compiled and optimized LAPACK 2.0 routines and also BLAS routines (upon which LAPACK routines depend)
    • Digital Extended Math Library, Version 3.3A (Digital Equipment Corp., 1997) contains compiled and optimized LAPACK 2.0 routines and also BLAS routines (upon which LAPACK routines depend).
    • (1997) Digital Extended Math Library, Version 3.3A
  • 24
    • 21544451943 scopus 로고
    • was released by University of Tennessee, University of California at Berkeley, NAG Ltd., Courant Institute, Argonne National Laboratory, and Rice University
    • LAPACK version 2.0 was released by University of Tennessee, University of California at Berkeley, NAG Ltd., Courant Institute, Argonne National Laboratory, and Rice University (1994);
    • (1994) LAPACK Version 2.0
  • 25
    • 21544434037 scopus 로고
    • Routines by from the modified for this work
    • Routines by E. Zakrajsek (1974) from the YAeHMOP code, modified for this work.
    • (1974) YAeHMOP Code
    • Zakrajsek, E.1
  • 26
    • 0004314105 scopus 로고    scopus 로고
    • See Cornell University, New York They were modified for this work. Similar routines (likely of the same origin) from the EHMACC source code (see Ref. 13) were used, unmodified
    • See G. Landrum, Yet Another Extended Hückel Molecular Orbital Package (YAeHMOP) User Manual version 2.0 (Cornell University, New York, 1997). They were modified for this work. Similar routines (likely of the same origin) from the EHMACC source code (see Ref. 13) were used, unmodified.
    • (1997) Yet Another Extended Hückel Molecular Orbital Package (YAeHMOP) User Manual Version 2.0
    • Landrum, G.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.