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Quantum Theory of Dissociative Chemisorption on Metal Surfaces
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
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Influence of molecular vibrations on dissociative adsorption
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Wide range nozzle beam adsorption data for the systems H2/nickel and H2/Pd(100)
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Six-dimensional quantum dynamics of adsorption and desorption of H2 at Pd(100): no need for a molecular precursor adsorption state
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Slab versus cluster approach for chemisorption studies. CO on Cu (100)
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Molecular knife throwing: aiming for dissociation at specific surface sites through state-selection
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Surface oscillator models for dissociative sticking of molecular hydrogen at non-rigid surfaces
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Six-dimensional quantum dynamics of dissociative chemisorption of H2 on metal surfaces
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Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Dynamics of Reactions at Surfaces
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Dynamics of N 2 sticking on W(100): the decisive role of van der Waals interactions
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Density functional theory study of thermodynamic and kinetic isotope effects of H 2 /D 2 dissociative adsorption on transition metals
inferred← citeshttps://doi.org/10.1039/d2cp01552hopenalex-snapshot
Adsorption properties of pyramidal superatomic molecules based on the structural framework of the Au 20 cluster
inferred← citeshttps://doi.org/10.1039/d2cp01560aopenalex-snapshot
Adiabatic models for the quantum dynamics of surface scattering with lattice effects
inferred← citeshttps://doi.org/10.1063/1.1506141openalex-snapshot
Signatures of site-specific reaction of H2 on Cu(100)
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On-the-fly localization of electronic orbitals in Car–Parrinello molecular dynamics
inferred← citeshttps://doi.org/10.1063/1.1637337openalex-snapshot
Application of the modified Shepard interpolation method to the determination of the potential energy surface for a molecule–surface reaction: H2+Pt(111)
inferred← citeshttps://doi.org/10.1063/1.1647519openalex-snapshot
High-dimensional quantum dynamical study of the dissociation of H2 on Pd(110)
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Multiconfigurational time-dependent Hartree calculations for dissociative adsorption of H2 on Cu(100)
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Reactive scattering of H2 from Cu(100): Six-dimensional quantum dynamics results for reaction and scattering obtained with a new, accurately fitted potential-energy surface
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Six-dimensional quantum dynamics of dissociative chemisorption of H2 on Ru(0001)
inferred← citeshttps://doi.org/10.1063/1.1900087openalex-snapshot
Mechanisms of H2 dissociative adsorption on the Pt(211) stepped surface
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Six-dimensional quantum dynamics of (v=,j=)D2 and of (v=1,j=)H2 scattering from Cu(111)
inferred← citeshttps://doi.org/10.1063/1.1924550openalex-snapshot
Relaxation of hot atoms following H2 dissociation on a Pd(111) surface
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The reaction rate for dissociative adsorption of N2 on stepped Ru(0001): Six-dimensional quantum calculations
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State-to-state scattering of D2 from Cu(100) and Pd(111)
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Off-normal incidence dissociative sticking of H2 on Cu(100) studied using six-dimensional quantum calculations
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Multiconfiguration time-dependent Hartree method applied to molecular dissociation on surfaces: H2+Pt(111)
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Ab initio based tight-binding molecular dynamics simulation of the sticking and scattering of O2∕Pt(111)
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Reactive and nonreactive scattering of N2 from Ru(0001): A six-dimensional adiabatic study
inferred← citeshttps://doi.org/10.1063/1.2798112openalex-snapshot
Dissociative chemisorption of H2 on the Cu(110) surface: A quantum and quasiclassical dynamical study
inferred← citeshttps://doi.org/10.1063/1.2813413openalex-snapshot
Supersonic molecular beam studies of dissociative adsorption of H2 on Ru(0001)
inferred← citeshttps://doi.org/10.1063/1.2897757openalex-snapshot
The role of exchange-correlation functionals in the potential energy surface and dynamics of N2 dissociation on W surfaces
inferred← citeshttps://doi.org/10.1063/1.3012354openalex-snapshot
Dissociative dynamics of spin-triplet and spin-singlet O2 on Ag(100)
inferred← citeshttps://doi.org/10.1063/1.3265854openalex-snapshot
Reactive force fields for surface chemical reactions: A case study with hydrogen dissociation on Pd surfaces
inferred← citeshttps://doi.org/10.1063/1.3308481openalex-snapshot
A new analytical potential energy surface for the adsorption system CO/Cu(100)
inferred← citeshttps://doi.org/10.1063/1.3378278openalex-snapshot
A theoretical study of H2 dissociation on (3×3)R30°CO/Ru(0001)
inferred← citeshttps://doi.org/10.1063/1.3389479openalex-snapshot
Dynamics simulation of N2 scattering onto W(100,110) surfaces: A stringent test for the recently developed flexible periodic London–Eyring–Polanyi–Sato potential energy surface
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Coverage effects in the adsorption of H2 on Pd(100) studied by ab initio molecular dynamics simulations
inferred← citeshttps://doi.org/10.1063/1.4774024openalex-snapshot
Surface temperature effects on the dynamics of N2 Eley-Rideal recombination on W(100)
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Permutation invariant polynomial neural network approach to fitting potential energy surfaces. III. Molecule-surface interactions
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A new Stark decelerator based surface scattering instrument for studying energy transfer at the gas-surface interface
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HCl dissociating on a rigid Au(111) surface: A six-dimensional quantum mechanical study on a new potential energy surface based on the RPBE functional
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Water dissociating on rigid Ni(100): A quantum dynamics study on a full-dimensional potential energy surface
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Dynamics in reactions on metal surfaces: A theoretical perspective
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Molecular Dynamics Study of Hydrogen Dissociation on Pd Surfaces using Reactive Force Fields
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Theoretical study of nonadiabatic hydrogen atom scattering dynamics on metal surfaces using the hierarchical equations of motion method
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Enhancing dissociative chemisorption of H 2 O on Cu(111) via vibrational excitation
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The sticking of H2(v= 1,J= 1) on Cu(100) measured using laser-induced thermal desorption
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Accurate metal–ligand bond energies in the η2-C2H4 and η2-C60 complexes of Pt(PH3)2, with application to their Bis(triphenylphosphine) analogues
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Porous Semiconductors: Advanced Material for Gas Sensor Applications
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Energy dissipation at metal surfaces
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Ab initiomolecular dynamics: basic concepts, current trends and novel applications
inferred← citeshttps://doi.org/10.1088/0953-8984/19/30/305003openalex-snapshot
Probing reaction dynamics at metal surfaces with H2diffraction
inferred← citeshttps://doi.org/10.1088/0957-4484/17/6/006openalex-snapshot
Adsorption of PTCDA on a partially KBr covered Ag(111) substrate
inferred← citeshttps://doi.org/10.1103/physrevb.72.035401openalex-snapshot
Quantum and classical dynamics of H 2 scattering from Pd(111) at off-normal incidence
inferred← citeshttps://doi.org/10.1103/physrevb.72.205404openalex-snapshot
Energy partitioning in the femtosecond-laser-induced associative D2 desorption from Ru(0001)
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Descriptions of surface chemical reactions using a neural network representation of the potential-energy surface
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Molecular dynamics study of H2 dissociation on H-covered Pd(100)
inferred← citeshttps://doi.org/10.1103/physrevb.83.125418openalex-snapshot
Molecular dynamics simulation of a complex surface reaction: The effect of coverage on H 2 dissociation on Pd(111)
inferred← citeshttps://doi.org/10.1103/physrevc.99.054620openalex-snapshot
Forbidden nuclear reactions
inferred← citeshttps://doi.org/10.1103/physrevlett.114.166101openalex-snapshot
Dynamics of Water Dissociative Chemisorption on Ni(111): Effects of Impact Sites and Incident Angles
inferred← citeshttps://doi.org/10.1103/physrevlett.93.246104openalex-snapshot
In-Plane and Out-of-Plane Diffraction of H2 from Metal Surfaces
inferred← citeshttps://doi.org/10.1103/physrevlett.94.246104openalex-snapshot
State-Resolved Gas-Surface Reactivity of Methane in the Symmetric C-H Stretch Vibration on Ni(100)
inferred← citeshttps://doi.org/10.1103/physrevlett.96.096102openalex-snapshot
Multidimensional Effects on Dissociation of N2 on Ru(0001)
inferred← citeshttps://doi.org/10.1103/physrevlett.98.206107openalex-snapshot
Hydrogen Dissociation Dynamics on Precovered Pd Surfaces: Langmuir is Still Right
inferred← citeshttps://doi.org/10.1109/icsens.2002.1037270openalex-snapshot
A Pt/Ga/sub 2/O/sub 3//SiC Schottky diode based hydrocarbon gas sensor
inferred← citeshttps://doi.org/10.1126/science.1088996openalex-snapshot
Vibrational Mode-Specific Reaction of Methane on a Nickel Surface
inferred← citeshttps://doi.org/10.1126/science.1123057openalex-snapshot
Reactive and Nonreactive Scattering of H 2 from a Metal Surface Is Electronically Adiabatic
inferred← citeshttps://doi.org/10.1126/science.1157717openalex-snapshot
Frontiers in Surface Scattering Simulations
inferred← citeshttps://doi.org/10.1134/1.2047801openalex-snapshot
To the quantum theory of chemical activity of the surface of transition metals
inferred← citeshttps://doi.org/10.1140/epjb/e2005-00197-0openalex-snapshot
Quantum dynamics of the dissociation of H2 on Rh(111)
inferred← citeshttps://doi.org/10.1142/s0219633605001647openalex-snapshot
SIX-DIMENSIONAL DYNAMICS OF DISSOCIATIVE CHEMISORPTION OF H 2ON METAL SURFACES
inferred← citeshttps://doi.org/10.1146/annurev-physchem-040214-121958openalex-snapshot
The Dynamics of Molecular Interactions and Chemical Reactions at Metal Surfaces: Testing the Foundations of Theory
inferred← citeshttps://doi.org/10.1201/b19205-3openalex-snapshot
Solid State Gas and Vapor Sensors Based on Porous Silicon
inferred← citeshttps://doi.org/10.1201/b19205-8openalex-snapshot
Solid State Gas and Vapor Sensors Based on Porous Silicon
inferred← citeshttps://doi.org/10.1515/zpch.2013.0410openalex-snapshot
Ready, Set and no Action: A Static Perspective on Potential Energy Surfaces commonly used in Gas-Surface Dynamics
inferred← citeshttps://doi.org/10.1524/zpch.2013.0410openalex-snapshot
Ready, Set and no Action: A Static Perspective on Potential Energy Surfaces commonly used in Gas-Surface Dynamics
inferred← citeshttps://doi.org/10.2139/ssrn.6304742openalex-snapshot
Dissociative Adsorption of a Single Water Molecule on [TaO]+ Enables Thermal Methane Activation Revealed by Gas-phase Reaction in Mass Spectrometry
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Basic Research Needs for the Hydrogen Economy. Report of the Basic Energy Sciences Workshop on Hydrogen Production, Storage and Use, May 13-15, 2003
inferred← citeshttps://doi.org/10.3103/s0146411616050072openalex-snapshot
Optimization algorithm of cognitive radio spectrum sensing based on quantum neural network
inferred← citeshttps://doi.org/10.3390/e16010322openalex-snapshot
Modeling Potential Energy Surfaces: From First-Principle Approaches to Empirical Force Fields
inferred← citeshttps://doi.org/10.48550/arxiv.1907.05211openalex-snapshot
On low-energy nuclear reactions
inferred← citeshttps://doi.org/10.48550/arxiv.cond-mat/0611714openalex-snapshot
Born-Oppenheimer Breakdown in Graphene
inferred← citeshttps://doi.org/10.5075/epfl-thesis-3335openalex-snapshot
Bond- and mode-specific reactivity of methane on Ni(100)
inferred← citeshttps://doi.org/10.5772/17054openalex-snapshot
Size- and Shape-Controlled Synthesis of Monodisperse Metal Oxide and Mixed Oxide Nanocrystals
inferred← citeshttps://doi.org/10.5772/6376openalex-snapshot
Practical Issues of Building Robust HMM Models Using HTK and SPHINX Systems
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REVIEW: CHEMICAL BONDS IN MOLECULAR AGGREGATION – FROM DRINKING WATER TO NANOCOMPOSITES
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Description théorique de la dynamique de recombinaison Eley-Rideal de l'azote moléculaire à la surface du tungstène
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Understanding Low Energy Nuclear Reactions
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