Nonadiabatic Molecular Dynamics Simulations of the Energy Transfer between Building Blocks in a Phenylene Ethynylene Dendrimer-Reference-Cited by-同舟云学术

Nonadiabatic Molecular Dynamics Simulations of the Energy Transfer between Building Blocks in a Phenylene Ethynylene Dendrimer

Published:2009-04-20 Issue:26 Volume:113 Page:7535-7542
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Fernandez-Alberti Sebastian¹,Kleiman Valeria D.¹,Tretiak Sergei¹,Roitberg Adrian E.¹

Affiliation:

1. Universidad Nacional de Quilmes, Roque Saenz Peña 352, B1876BXD Bernal, Argentina, Department of Chemistry, University of Florida, Gainesville, Florida 32611, Theoretical Division, Center for Nonlinear Studies (CNLS), and Center for Integrated Nanotechnologies (CINT), Los Alamos National Laboratory, Los Alamos, New Mexico 87545, and Quantum Theory Project, Department of Chemistry, University of Florida, Gainesville, Florida 32611

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp900904q

Reference80 articles.

1. Molecular dynamics with electronic transitions

2. Nonadiabatic molecular dynamics

3. Proton transfer in solution: Molecular dynamics with quantum transitions

4. Molecular Devices and Machines– A Journey into the Nano World

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