. "Cyril, Falvo" . "Mukamel, Shaul" . . "Quasi-Particle Approach to 2D IR Spectra of Vibrational Excitons in Biomolecules; Molecular Dynamics versus Stochastic Simulation Protocols"@en . "RIV/00216208:11320/13:10190122" . . . "\u0160anda, Franti\u0161ek" . . "978-1-4665-1013-5" . "Quasi-Particle Approach to 2D IR Spectra of Vibrational Excitons in Biomolecules; Molecular Dynamics versus Stochastic Simulation Protocols" . . . "1"^^ . . . . "Quasi-Particle Approach to 2D IR Spectra of Vibrational Excitons in Biomolecules; Molecular Dynamics versus Stochastic Simulation Protocols"@en . "We summarized our developments of quasiparticle approaches for calculating 2D-IR spectra of e.g. liquid water, amylophybrils, and organic solute-solvent complexes. Two approaches molecular dynamics (MD-NEE) and phenomenologic stochastic models (SNEE) for modelling Hamiltonian fluctuations are revviewed. In the present paper, we generalized previous contributions into the unified approach which includes both MD-NEE and SNEE (previously treated quite separately) as special cases." . "36"^^ . "487"^^ . . . "Quasi-Particle Approach to 2D IR Spectra of Vibrational Excitons in Biomolecules; Molecular Dynamics versus Stochastic Simulation Protocols" . "3"^^ . "[FF7909BC45AE]" . "I, P(GAP205/10/0989)" . "11320" . "Ultrafast Infrared Vibrational Spectroscopy" . . "RIV/00216208:11320/13:10190122!RIV14-GA0-11320___" . "CRC Press, Taylor & Francis Group" . . "We summarized our developments of quasiparticle approaches for calculating 2D-IR spectra of e.g. liquid water, amylophybrils, and organic solute-solvent complexes. Two approaches molecular dynamics (MD-NEE) and phenomenologic stochastic models (SNEE) for modelling Hamiltonian fluctuations are revviewed. In the present paper, we generalized previous contributions into the unified approach which includes both MD-NEE and SNEE (previously treated quite separately) as special cases."@en . . . "101245" . "Neuveden" . . "molecular dynamics; stochastic quantum dynamics; infrared spectroscopy; 2D spectroscopy"@en . . "Boca Ranton, USA" .