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s–d Electronic Interaction Induced H2 Dissociation on the γ-U(100) Surface and Influences of Niobium Doping
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
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Improved grid‐based algorithm for Bader charge allocation
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Density functional study of O2 adsorption on (100) surface of γ‐uranium
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Constants of diatomic molecules
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The Chemical Physics of Solid Surfaces and Heterogeneous Catalysis
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Ab-initio calculations of the hydrogen–uranium system: Surface phenomena, absorption, transport and trapping
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Ab initio calculations of the uranium–hydrogen system: Thermodynamics, hydrogen saturation of α-U and phase-transformation to UH3
inferredcites →https://doi.org/10.1016/j.apsusc.2006.12.119openalex-snapshot
Catalysis, by amorphous carbon, of H2 attack on oxidized U–0.1wt% Cr surfaces
inferredcites →https://doi.org/10.1016/j.jallcom.2006.10.069openalex-snapshot
A density functional study of carbon monoxide adsorption on (100) surface of γ-uranium
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Theoretical study on the alloying behavior of γ-uranium metal: γ-uranium alloy with 3d transition metals
inferredcites →https://doi.org/10.1016/j.jnucmat.2007.11.003openalex-snapshot
Quantum mechanical calculations of uranium phases and niobium defects in γ-uranium
inferredcites →https://doi.org/10.1016/s0022-3115(00)00238-5openalex-snapshot
Effect of silicon impurities and heat treatment on uranium hydriding rates
inferredcites →https://doi.org/10.1016/s0925-8388(97)00411-8openalex-snapshot
Experimental verification of the formal nucleation and growth rate equations – initial UH3 development on uranium surface
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Thin layers in actinide research
inferredcites →https://doi.org/10.1021/ar010104uopenalex-snapshot
Quantum Theory of Dissociative Chemisorption on Metal Surfaces
inferredcites →https://doi.org/10.1021/j100568a010openalex-snapshot
Alternative model for nonstoichiometry in uranium hydride
inferredcites →https://doi.org/10.1021/j150623a019openalex-snapshot
Diffusion with chemical reaction and a moving boundary
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Dissociative hydrogen adsorption on palladium requires aggregates of three or more vacancies
inferredcites →https://doi.org/10.1063/1.1680105openalex-snapshot
Kinetics of the uranium-hydrogen system
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The adsorption of O2 on Pb films and the effect of quantum modulation: A first-principles prediction
inferredcites →https://doi.org/10.1063/1.465278openalex-snapshot
Interaction of oxygen with Al(111) studied by scanning tunneling microscopy
inferredcites →https://doi.org/10.1073/pnas.0611024104openalex-snapshot
Experimental observation of quantum oscillation of surface chemical reactivities
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The dissociation of diatomic molecules at surfaces
inferredcites →https://doi.org/10.1088/0953-8984/20/44/445001openalex-snapshot
Hydrogen adsorption, dissociation and diffusion on the α-U(001) surface
inferredcites →https://doi.org/10.1088/1757-899x/9/1/012037openalex-snapshot
Carbon enhanced hydrogen attack on an oxidized U-0.1wt%Cr surface
inferredcites →https://doi.org/10.1103/physrevb.13.5188openalex-snapshot
Special points for Brillouin-zone integrations
inferredcites →https://doi.org/10.1103/physrevb.45.13709openalex-snapshot
Fractional occupations and density-functional energies and forces
inferredcites →https://doi.org/10.1103/physrevb.54.11169openalex-snapshot
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
inferredcites →https://doi.org/10.1103/physrevb.57.2493openalex-snapshot
Ab initio quantum and molecular dynamics of the dissociative adsorption of hydrogen on Pd(100)
inferredcites →https://doi.org/10.1103/physrevb.59.1758openalex-snapshot
From ultrasoft pseudopotentials to the projector augmented-wave method
inferredcites →https://doi.org/10.1103/physrevb.63.205412openalex-snapshot
Vibrational and rotational population distribution of D2 associatively desorbing from Pd(100)
inferredcites →https://doi.org/10.1103/physrevb.7.4454openalex-snapshot
Relativistic Energy Band Structure and Properties of γ -Uranium
inferredcites →https://doi.org/10.1103/physrevb.72.085101openalex-snapshot
Molecular hydrogen adsorption and dissociation on the plutonium (111) surface
inferredcites →https://doi.org/10.1103/physrevb.75.115409openalex-snapshot
Nonadiabatic potential-energy surfaces by constrained density-functional theory
inferredcites →https://doi.org/10.1103/physrevb.80.073406openalex-snapshot
Activated dissociation of O2 on Pb(111) surfaces by Pb adatoms
inferredcites →https://doi.org/10.1103/physrevb.82.073406openalex-snapshot
Activated O2 dissociation and formation of oxide islands on Be(0001): An atomistic model for metal oxidation
inferredcites →https://doi.org/10.1103/physrevlett.55.1583openalex-snapshot
H2 Dissociation at Metal Surfaces
inferredcites →https://doi.org/10.1103/physrevlett.68.624openalex-snapshot
Surface migration of ‘‘hot’’ adatoms in the course of dissociative chemisorption of oxygen on Al(111)
inferredcites →https://doi.org/10.1103/physrevlett.77.3865openalex-snapshot
Generalized Gradient Approximation Made Simple
inferredcites →https://doi.org/10.1103/physrevlett.78.1396openalex-snapshot
Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)]
inferredcites →https://doi.org/10.1103/physrevlett.84.705openalex-snapshot
Oxygen Molecule Dissociation on the Al(111) Surface
inferredcites →https://doi.org/10.1103/physrevlett.94.036104openalex-snapshot
Dissociation of O 2 at Al(111): The Role of Spin Selection Rules
inferredcites →https://doi.org/10.1103/physrevlett.98.206107openalex-snapshot
Hydrogen Dissociation Dynamics on Precovered Pd Surfaces: Langmuir is Still Right
inferredcites →https://doi.org/10.1116/1.1881637openalex-snapshot
Carbon monoxide reaction with UO2(111) single crystal surfaces: A theoretical and experimental study
inferredcites →https://doi.org/10.1126/science.1123057openalex-snapshot
Reactive and Nonreactive Scattering of H 2 from a Metal Surface Is Electronically Adiabatic
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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First-Principles Study of Adsorption, Dissociation and Diffusion of Oxygen on Α-U (110) Surface
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Oxygen adsorption and diffusion on γ-U(0 0 1) surface: Effect of titanium
inferred← citeshttps://doi.org/10.1016/j.commatsci.2023.112025openalex-snapshot
The interaction of oxygen with the γ-U (001) and (110) surfaces: An ab initio study
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Insight into the mechanism of abnormal degradation of duplex U-Nb alloy
inferred← citeshttps://doi.org/10.1016/j.ijhydene.2025.152806openalex-snapshot
Hydrogenation kinetics on the α-U (001) surface: Nb doping and DFT + U-D3
inferred← citeshttps://doi.org/10.1016/j.jnucmat.2024.154964openalex-snapshot
Initial oxidation behavior of α-U and γ-U surfaces
inferred← citeshttps://doi.org/10.1016/j.jnucmat.2025.156281openalex-snapshot
Hydrogen corrosion behavior of Nb-doped α-U(001) surface: A DFT+U study
inferred← citeshttps://doi.org/10.1016/j.matdes.2026.115712openalex-snapshot
Revealing the mechanism of uranium anti hydrogen embrittlement modification: Segregation law and strengthening effect of metal solute doped grain boundaries
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First-principles calculations of methane adsorption at different coverage on the kaolinite (001) surface
inferred← citeshttps://doi.org/10.1016/j.physb.2025.417841openalex-snapshot
Density functional theory (DFT+D3) study on the adsorption of water on the γ-U(100) surface
inferred← citeshttps://doi.org/10.1016/j.pnucene.2020.103268openalex-snapshot
Investigating the solution and diffusion properties of hydrogen in α -Uranium by first-principles calculations
inferred← citeshttps://doi.org/10.1016/j.rineng.2025.105753openalex-snapshot
Determination of elastic-plastic properties of hydride precipitate in uranium matrix by nanoindentation and finite element analysis
inferred← citeshttps://doi.org/10.1016/j.surfrep.2026.100697openalex-snapshot
Theoretical insights into intermetallic compound surfaces in hydrogen-involving catalytic reactions
inferred← citeshttps://doi.org/10.1021/acs.jpcc.1c00052openalex-snapshot
What is the Role of Nb on Preferential Hydriding of Double-Phased Uranium, Stabilizing γ-U, or Avoiding Hydrogen Aggregation?
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Influences of Surface Substitutional Ti Atom on Hydrogen Adsorption, Dissociation, and Diffusion Behaviors on the α-U(001) Surface
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Structural and electronic properties of UnOm (n=1-3,m=1-3n) clusters: A theoretical study using screened hybrid density functional theory
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First-principles study of adsorption, dissociation, and diffusion of hydrogen on α-U (110) surface
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Electronic structures and physical properties of α -uranium hydride under shock compression
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First-principles molecular dynamics study of water dissociation on theγ-U(1 0 0) surface
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A first-principles study on hydrogen distributions in the α -U/UO 2 interface
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Research Progress on Surface Corrosion of Uranium Materials
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First principles study of hydrogen adsorption and dissociation behavior on γ-U (100)/Mo surface
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