Path-integral isomorphic Hamiltonian for including nuclear quantum effects in non-adiabatic dynamics
Author:
Affiliation:
1. Division of Chemistry and Chemical Engineering, California Institute of Technology, Pasadena, California 91125, USA
Funder
DOD | United States Navy | Office of Naval Research
DOD | USAF | AFMC | Air Force Office of Scientific Research
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/am-pdf/10.1063/1.5005544
Reference71 articles.
1. Photodissociation Dynamics of Phenol: Multistate Trajectory Simulations including Tunneling
2. Isomerization Through Conical Intersections
3. Tryptophan-Accelerated Electron Flow Through Proteins
4. Mimicking Protein−Protein Electron Transfer: Voltammetry of Pseudomonas aeruginosa Azurin and the Thermus thermophilus CuA Domain at ω-Derivatized Self-Assembled-Monolayer Gold Electrodes
5. Inverse Velocity Dependence of Vibrationally Promoted Electron Emission from a Metal Surface
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