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Volumn 114, Issue 50, 2010, Pages 22289-22302

Molecular engineering of benzothiazolium salts with large quadratic hyperpolarizabilities: Can auxiliary electron-withdrawing groups enhance nonlinear optical responses?

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE RING; COMPUTATIONAL STUDIES; ELECTRON WITHDRAWING GROUP; ELECTRON-DONATING; HYPER RAYLEIGH SCATTERING; HYPERPOLARIZABILITIES; INTRAMOLECULAR CHARGE TRANSFERS; MOLECULAR ENGINEERING; NEGATIVE IMPACTS; NONLINEAR OPTICAL PROPERTIES; NONLINEAR OPTICAL RESPONSE; ONE PHOTON ABSORPTION; POSITIVE EFFECTS; PUSH-PULL CHROMOPHORES; QUANTUM-CHEMICAL CALCULATION; RED SHIFT; SUBSTITUTION PATTERNS; UV VISIBLE SPECTROSCOPY;

EID: 79951625602     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp108623d     Document Type: Article
Times cited : (113)

References (87)
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    • (2004) SAINT-Plus and APEX2
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    • TURBOMOLE, a development of University of Karlsruhe and Forschungszentrum Karlsruhe GmbH, version 6.0, 2009.
  • 81
    • 79951628694 scopus 로고    scopus 로고
    • Because a dipole moment is not a well-defined quantity for charged systems if the counterion is not taken into account, we prefer to discuss the observed trends in terms of the adiabatic dipole moment change between the ground state and the first excited state
    • Because a dipole moment is not a well-defined quantity for charged systems if the counterion is not taken into account, we prefer to discuss the observed trends in terms of the adiabatic dipole moment change between the ground state and the first excited state.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.