Literature DB >> 15847451

Vibronic energies and spectra of molecular dimers.

A Eisfeld1, L Braun, W T Strunz, J S Briggs, J Beck, V Engel.   

Abstract

We consider three distinct methods of calculating the vibronic levels and absorption spectra of molecular dimers coupled by dipole-dipole interactions. The first method is direct diagonalization of the vibronic Hamiltonian in a basis of monomer eigenstates. The second method is to use creation and annihilation operators leading in harmonic approximation to the Jaynes-Cummings Hamiltonian. The adiabatic approximation to this problem provides insight into spectral behavior in the weak and strong coupling limits. The third method, which serves as a check on the accuracy of the previous methods, is a numerically exact solution of the time-dependent Schrodinger equation. Using these methods, dimer spectra are calculated for three separate dye molecules and show good agreement with measured spectra.

Entities:  

Year:  2005        PMID: 15847451     DOI: 10.1063/1.1861883

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  3 in total

1.  Temperature-dependent conformations of exciton-coupled Cy3 dimers in double-stranded DNA.

Authors:  Loni Kringle; Nicolas P D Sawaya; Julia Widom; Carson Adams; Michael G Raymer; Alán Aspuru-Guzik; Andrew H Marcus
Journal:  J Chem Phys       Date:  2018-02-28       Impact factor: 3.488

2.  Measuring local conformations and conformational disorder of (Cy3)2 dimer labeled DNA fork junctions using absorbance, circular dichroism and two-dimensional fluorescence spectroscopy.

Authors:  Dylan Heussman; Justin Kittell; Loni Kringle; Amr Tamimi; Peter H von Hippel; Andrew H Marcus
Journal:  Faraday Discuss       Date:  2019-07-11       Impact factor: 4.008

3.  Exciton dynamics in perturbed vibronic molecular aggregates.

Authors:  C Brüning; J Wehner; J Hausner; M Wenzel; V Engel
Journal:  Struct Dyn       Date:  2015-11-17       Impact factor: 2.920

  3 in total

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