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Volumn 127, Issue 16, 2007, Pages

Analysis and prediction of absorption band shapes, fluorescence band shapes, resonance Raman intensities, and excitation profiles using the time-dependent theory of electronic spectroscopy

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; ELECTRONIC STRUCTURE; GROUND STATE; RAMAN SCATTERING; RESONANCE; WAVE PACKETS;

EID: 36048945644     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2770706     Document Type: Article
Times cited : (269)

References (107)
  • 56
    • 36048968639 scopus 로고    scopus 로고
    • Homogeneous broadening is accounted for in the simplest possible way by the phenomenological factor e-Γt which results in Lorentzian line shapes for absorption bands and rR excitation profiles. In addition to lifetime effects this factor accounts also for the intermolecular and solvent contributions that fluctuate quickly on the Raman time scale, as well as for contributions from weakly displaced modes that are neglected in the analysis
    • -Γt which results in Lorentzian line shapes for absorption bands and rR excitation profiles. In addition to lifetime effects this factor accounts also for the intermolecular and solvent contributions that fluctuate quickly on the Raman time scale, as well as for contributions from weakly displaced modes that are neglected in the analysis.
  • 58
    • 36049043594 scopus 로고    scopus 로고
    • 0n explicitly.
    • 0n explicitly.
  • 79
    • 36049022292 scopus 로고    scopus 로고
    • TURBOMOLE library: ftp://ftp.chemie.uni-karlsruhe.de/pub/basen
    • TURBOMOLE library: ftp://ftp.chemie.uni-karlsruhe.de/pub/basen


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.