Research graph
References from Determining the Effect of Hot Electron Dissipation on Molecular Scattering Experiments at Metal Surfaces. Local targets link to admitted publications; unresolved targets remain external evidence.
Perspective: Nonadiabatic dynamics theory
10.1063/1.4757762 · 2012 · External reference
Non-adiabatic effects in elementary reaction processes at metal surfaces
10.1016/j.progsurf.2017.09.002 · 2017 · External reference
Energy dissipation at metal surfaces
10.1080/23746149.2017.1381574 · 2018 · External reference
Electronically non-adiabatic influences in surface chemistry and dynamics
10.1039/c6cs00078a · 2016 · External reference
Vibrational promotion of electron transfer
10.1126/science.290.5489.111 · 2000 · External reference
Chemically induced electronic excitations at metal surfaces
10.1126/science.1066134 · 2001 · External reference
Electronic excitations induced by hydrogen surface chemical reactions on gold
10.1063/1.3523647 · 2011 · External reference
Disentangling Multidimensional Nonequilibrium Dynamics of Adsorbates: CO Desorption from Cu(100)
10.1103/physrevlett.117.186101 · 2016 · External reference
The dynamics of molecular interactions and chemical reactions at metal surfaces: Testing the foundations of theory
10.1146/annurev-physchem-040214-121958 · 2015 · External reference
Nonadiabatic dynamics at metal surfaces: Independent-electron surface hopping
10.1063/1.3125436 · 2009 · External reference
A broadened classical master equation approach for nonadiabatic dynamics at metal surfaces: Beyond the weak molecule-metal coupling limit
10.1063/1.4939734 · 2016 · External reference
Ab initio tensorial electronic friction for molecules on metal surfaces: Nonadiabatic vibrational relaxation
10.1103/physrevb.94.115432 · 2016 · External reference
Mixed Quantum-Classical Dynamics Using Collective Electronic Variables: A Better Alternative to Electronic Friction Theories
10.1021/acs.jpclett.6b02712 · 2017 · External reference
Universality of electronic friction. II. Equivalence of the quantum-classical Liouville equation approach with von Oppen’s nonequilibrium Green’s function methods out of equilibrium
10.1103/physrevb.97.064303 · 2018 · External reference
Model Hamiltonian for the interaction of NO with the Au(111) surface
10.1063/1.3122989 · 2009 · External reference
Dynamical steering and electronic excitation in NO scattering from a gold surface
10.1126/science.1179240 · 2009 · External reference
Molecular dynamics with electronic transitions
10.1063/1.459170 · 1990 · External reference
Signatures of nonadiabatic O2 dissociation at Al(111): First-principles fewest-switches study
10.1103/physrevb.81.035410 · 2010 · External reference
Electronic damping of atomic and molecular vibrations at metal surfaces
10.1088/0031-8949/29/4/014 · 1984 · External reference
Molecular dynamics with electronic frictions
10.1063/1.469915 · 1995 · External reference
Perspective: How to understand electronic friction
10.1063/1.5035412 · 2018 · External reference
Role of electron-hole pair excitations in the dissociative adsorption of diatomic molecules on metal surfaces
10.1103/physrevlett.100.116102 · 2008 · External reference
Role of tensorial electronic friction in energy transfer at metal surfaces
10.1103/physrevlett.116.217601 · 2016 · External reference
Mode specific electronic friction in dissociative chemisorption on metal surfaces: H2 on Ag(111)
10.1103/physrevlett.118.256001 · 2017 · External reference
Testing electronic friction models: Vibrational de-excitation in scattering of H2 and D2 from Cu(111)
10.1021/acs.jpclett.7b03182 · 2018 · External reference
Hot electron effects during reactive scattering of H2 from Ag(111): assessing the sensitivity to initial conditions, coupling magnitude, and electronic temperature
10.1039/c8fd00140e · 2019 · External reference
Hot-electron effects during reactive scattering of H2 from Ag(111): the interplay between mode-specific electronic friction and the potential energy landscape
10.1039/c8sc03955k · 2019 · External reference
Orbital-dependent electronic friction significantly affects the description of reactive scattering of N2 from Ru(0001)
10.1021/acs.jpclett.9b00523 · 2019 · External reference
When is electronic friction reliable for dynamics at a molecule–metal interface?
10.1039/c7cp08249e · 2018 · External reference
Energy transfer at metal surfaces: the need to go beyond the electronic friction picture
10.1039/c1sc00181g · 2011 · External reference
NO Vibrational Energy Transfer on a Metal Surface: Still a Challenge to First-Principles Theory
10.1021/acs.jpcc.5b00388 · 2015 · External reference
Observation of vibrational excitation and deexcitation for NO(v = 2) scattering from Au(111): evidence of electron-hole pair mediated energy transfer
10.1103/physrevlett.84.2985 · 2000 · External reference
Multiquantum vibrational excitation of NO scattered from Au(111): quantitative comparison of benchmark data to ab initio theories of nonadiabatic molecule-surface interactions
10.1002/anie.201201168 · 2012 · External reference
State-to-state time-of-flight measurements of NO scattering from Au(111): direct observation of translation-to-vibration coupling in electronically nonadiabatic energy transfer
10.1021/jp403382b · 2013 · External reference
Controlling an electron-transfer reaction at a metal surface by manipulating reactant motion and orientation
10.1002/anie.201407051 · 2014 · External reference
The importance of accurate adiabatic interaction potentials for the correct description of electronically nonadiabatic vibrational energy transfer: a combined experimental and theoretical study of NO(v = 3) collisions with a Au(111) surface
10.1063/1.4861660 · 2014 · External reference
Monte Carlo wave packet study of vibrational deexcitation of NO scattered from a metal surface
10.1063/1.1498479 · 2002 · External reference
Role of electronic friction during the scattering of vibrationally excited nitric oxide molecules from Au(111)
10.1103/physrevb.82.075404 · 2010 · External reference
High-Fidelity Potential Energy Surfaces for Gas-Phase and Gas–Surface Scattering Processes from Machine Learning
10.1021/acs.jpclett.0c00989 · 2020 · External reference
Strong Vibrational Relaxation of NO Scattered from Au(111): Importance of the Adiabatic Potential Energy Surface
10.1021/acs.jpclett.9b01806 · 2019 · External reference
Symmetry-Adapted High Dimensional Neural Network Representation of Electronic Friction Tensor of Adsorbates on Metals
10.1021/acs.jpcc.9b09965 · 2020 · External reference
Scattering of NO(ν = 3) from Au(111): a stochastic dissipative quantum dynamical perspective
10.1039/c9cp06084g · 2020 · External reference
Unresolved reference
External reference
Insensitivity of trapping at surfaces to molecular vibration
10.1016/j.cplett.2005.06.031 · 2005 · External reference
Observation of orientation-dependent electron transfer in molecule-surface collisions
10.1073/pnas.1312200110 · 2013 · External reference
Electron-mediated phonon-phonon coupling drives the vibrational relaxation of CO on Cu(100)
10.1103/physrevlett.120.156804 · 2018 · External reference
Vibrational excitation in molecule-surface collisions due to temporary negative molecular ion formation
10.1063/1.445742 · 1983 · External reference
Temperature programmed desorption of weakly bound adsorbates on Au(111)
10.1016/j.susc.2015.06.010 · 2016 · External reference
Unresolved reference
External reference
Mechanistic Insights into Photocatalyzed H2 Dissociation on Au Clusters
10.1021/jacs.0c04491 · 2020 · External reference
Efficient iterative schemes for ab initio total-energy calculations using plane wave basis set
10.1103/physrevb.54.11169 · 1996 · External reference
Efficiency of ab initio total energy calculations for metals and semiconductors using plane wave basis set
10.1016/0927-0256(96)00008-0 · 1996 · External reference
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
10.1103/physrevb.46.6671 · 1992 · External reference
Ab initio molecular simulations with numeric atom-centered orbitals
10.1016/j.cpc.2009.06.022 · 2009 · External reference
VECTORIZATION OF THE GENERAL MONTE-CARLO CLASSICAL TRAJECTORY PROGRAM VENUS
10.1002/jcc.540120814 · 1991 · External reference
Embedded atom neural network potentials: Efficient and accurate machine learning with a physically inspired representation
10.1021/acs.jpclett.9b02037 · 2019 · External reference
Efficient Construction of Excited-State Hessian Matrices with Machine Learning Accelerated Multilayer Energy-Based Fragment Method
10.1021/acs.jpca.0c04117 · 2020 · External reference
Unified and Transferable Description of Dynamics for H2 Dissociative Adsorption on Multiple Copper Surfaces via Machine Learning
10.1039/d0cp02291h · 2020 · External reference
