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Volumn 118, Issue 8, 2003, Pages 3480-3490

Correlation between electronic and molecular structure distortions and vibrational properties. I. Adiabatic approximations

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; COMPUTER SIMULATION; CORRELATION METHODS; DISTORTION (WAVES); ELECTRON ENERGY LEVELS; ELECTRONIC STRUCTURE; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS; PERTURBATION TECHNIQUES;

EID: 0037460536     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1536979     Document Type: Article
Times cited : (65)

References (33)
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    • Kurts, H.A.1    Stewart, J.J.2    Dieter, K.M.3
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    • 0001751863 scopus 로고
    • J. M. Andre, J. Delhalle, and J. L. Bredas, Quantum Chemistry Aided Design of Organic Polymers: An Introduction to the Quantum Chemistry of Polymers and Its Applications (World Scientific, Singapore, 1991); H. A. Kurts, J. J. Stewart, and K. M. Dieter, J. Comput. Chem. 11, 82 (1990); F. Sim, S. Chin, M. Dupuis, and J. Rice, J. Phys. Chem. 97, 1158 (1993); C. Dehu, F. Meyers, and J. L. Bredas, J. Am. Chem. Soc. 115, 6198 (1993).
    • (1993) J. Phys. Chem. , vol.97 , pp. 1158
    • Sim, F.1    Chin, S.2    Dupuis, M.3    Rice, J.4
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    • J. M. Andre, J. Delhalle, and J. L. Bredas, Quantum Chemistry Aided Design of Organic Polymers: An Introduction to the Quantum Chemistry of Polymers and Its Applications (World Scientific, Singapore, 1991); H. A. Kurts, J. J. Stewart, and K. M. Dieter, J. Comput. Chem. 11, 82 (1990); F. Sim, S. Chin, M. Dupuis, and J. Rice, J. Phys. Chem. 97, 1158 (1993); C. Dehu, F. Meyers, and J. L. Bredas, J. Am. Chem. Soc. 115, 6198 (1993).
    • (1993) J. Am. Chem. Soc. , vol.115 , pp. 6198
    • Dehu, C.1    Meyers, F.2    Bredas, J.L.3
  • 30
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    • J. Cioslowski and M. Martinov, J. Chem. Phys. 101, 366 (1994); B. G. Baekelandt, G. O. A. Janssens, H. Toufar, W. J. Mortier, R. A. Schoonheydt, and R. F. Nalewajski, J. Phys. Chem. 99, 9784 (1995).
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