Ab initio tensorial electronic friction for molecules on metal surfaces: Nonadiabatic vibrational relaxation
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September 2016 |
High-Voltage-Assisted Mechanical Stabilization of Single-Molecule Junctions
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June 2018 |
Kinetic Schemes in Open Interacting Systems
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August 2018 |
Current-Induced Forces for Nonadiabatic Molecular Dynamics
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October 2018 |
Nonradiative Relaxation of Photoexcited Black Phosphorus Is Reduced by Stacking with MoS 2 : A Time Domain ab Initio Study
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May 2016 |
How to calculate linear absorption spectra with lifetime broadening using fewest switches surface hopping trajectories: A simple generalization of ground-state Kubo theory
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July 2014 |
NO Vibrational Energy Transfer on a Metal Surface: Still a Challenge to First-Principles Theory
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January 2015 |
Phase-only laser control in the weak-field limit: Two-pulse control of IBr photofragmentation revisited
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January 2016 |
A many-body states picture of electronic friction: The case of multiple orbitals and multiple electronic states
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August 2016 |
Electronically driven adsorbate excitation mechanism in femtosecond-pulse laser desorption
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August 1995 |
Appraisal of Surface Hopping as a Tool for Modeling Condensed Phase Linear Absorption Spectra
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August 2015 |
Vibrational cooling, heating, and instability in molecular conducting junctions: full counting statistics analysis
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January 2012 |
Nonequilibrium diagrammatic technique for Hubbard Green functions
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March 2017 |
Calculating time-resolved differential absorbance spectra for ultrafast pump-probe experiments with surface hopping trajectories
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October 2014 |
Electron–Hole Pair Effects in Polyatomic Dissociative Chemisorption: Water on Ni(111)
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January 2016 |
Suppressed Quenching and Strong-Coupling of Purcell-Enhanced Single-Molecule Emission in Plasmonic Nanocavities
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November 2017 |
Role of Tensorial Electronic Friction in Energy Transfer at Metal Surfaces
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May 2016 |
Molecular dynamics with electronic frictions
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December 1995 |
Current-Induced Forces and Hot Spots in Biased Nanojunctions
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March 2015 |
Photo-induced 1,3-cyclohexadiene ring opening reaction: Ab initio on-the-fly nonadiabatic molecular dynamics simulation
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February 2016 |
Computational Design of a Family of Light-Driven Rotary Molecular Motors with Improved Quantum Efficiency
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December 2015 |
Towards Noise Simulation in Interacting Nonequilibrium Systems Strongly Coupled to Baths
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August 2017 |
Nonadiabatic dynamics at metal surfaces: Independent electron surface hopping with phonon and electron thermostats
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January 2012 |
Single-Molecule Investigation of Energy Dynamics in a Coupled Plasmon-Exciton System
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July 2017 |
Mixed quantum-classical dynamics for charge transport in organics
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January 2015 |
Current-induced atomic dynamics, instabilities, and Raman signals: Quasiclassical Langevin equation approach
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June 2012 |
Scattering theory of adiabatic reaction forces due to out-of-equilibrium quantum environments
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November 2012 |
Nonadiabatic Excited-State Molecular Dynamics: Modeling Photophysics in Organic Conjugated Materials
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February 2014 |
Origin of Vibrational Instabilities in Molecular Wires with Separated Electronic States
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May 2018 |
Laserlike Vibrational Instability in Rectifying Molecular Conductors
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July 2011 |
Many-Body State Description of Single-Molecule Electroluminescence Driven by a Scanning Tunneling Microscope
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January 2019 |
Real-space investigation of energy transfer in heterogeneous molecular dimers
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October 2016 |
Single-molecule strong coupling at room temperature in plasmonic nanocavities
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June 2016 |
Molecular junctions and molecular motors: Including Coulomb repulsion in electronic friction using nonequilibrium Green's functions
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July 2018 |
A Surface Hopping View of Electrochemistry: Non-Equilibrium Electronic Transport through an Ionic Solution with a Classical Master Equation
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August 2015 |
Doping effect on photoabsorption and charge-separation dynamics in light-harvesting organic molecule
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January 2016 |
Can Surface Hopping sans Decoherence Recover Marcus Theory? Understanding the Role of Friction in a Surface Hopping View of Electron Transfer
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May 2014 |
Current-induced forces in mesoscopic systems: A scattering-matrix approach
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January 2012 |
Born-Oppenheimer Dynamics, Electronic Friction, and the Inclusion of Electron-Electron Interactions
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July 2017 |
Nonadiabatic Dynamics May Be Probed through Electronic Coherence in Time-Resolved Photoelectron Spectroscopy
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January 2016 |
Scattering Theory of Current-Induced Forces in Mesoscopic Systems
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July 2011 |
Semiclassical Path Integral Dynamics: Photosynthetic Energy Transfer with Realistic Environment Interactions
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May 2016 |
Frictional effects near a metal surface
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August 2015 |
Universality of electronic friction: Equivalence of von Oppen's nonequilibrium Green's function approach and the Head-Gordon–Tully model at equilibrium
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September 2017 |
Nonadiabatic dynamics of electrons and atoms under nonequilibrium conditions
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July 2018 |
Laser-like vibrational instability in rectifying molecular conductors
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text
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January 2011 |
Vibrational cooling, heating, and instability in molecular conducting junctions: Full counting statistics analysis
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text
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January 2012 |
Current-induced atomic dynamics, instabilities, and Raman signals: Quasi-classical Langevin equation approach
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text
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January 2012 |
Scattering theory of adiabatic reaction forces due to out-of-equilibrium quantum environments
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text
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January 2012 |
The Role of Tensorial Electronic Friction in Energy Transfer at Metal Surfaces
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text
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January 2016 |
High voltage assisted mechanical stabilization of single-molecule junctions
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January 2017 |
Molecular junctions and molecular motors: Including Coulomb repulsion in electronic friction using nonequilibrium Green's functions
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January 2017 |
Current-induced forces for nonadiabatic molecular dynamics
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January 2018 |
Non-adiabatic dynamics of electrons and atoms under non-equilibrium conditions
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January 2018 |