Development of a Virtual Spectrometer for Chiroptical Spectroscopies: The Case of Nicotine

Lignende værker

• New developments of a multifrequency virtual spectrometer: stereo-electronic, dynamical and environmental effects on chiroptical spectra
  af: Barone, Vincenzo, et al.
  Udgivet: (2014)
• A robust and effective time-independent route to the calculation of Resonance Raman spectra of large molecules in condensed phases with the inclusion of Duschinsky, Herzberg-Teller, anharmonic, and environmental effects
  af: Egidi, Franco, et al.
  Udgivet: (2014)
• The Virtual Multifrequency Spectrometer: a new paradigm for spectroscopy
  af: Barone, Vincenzo
  Udgivet: (2016)
• Accurate structure, thermodynamics and spectroscopy of medium-sized radicals by hybrid Coupled Cluster/Density Functional Theory approaches: the case of phenyl radical
  af: Barone, Vincenzo, et al.
  Udgivet: (2013)
• Stereo-electronic, vibrational, and environmental contributions to polarizabilities of large molecular systems: a feasible anharmonic protocol
  af: Egidi, Franco, et al.
  Udgivet: (2014)