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DFT-Based Cu(111)||Cu<sub>2</sub>O(111) Model for Copper Metal Covered by Ultrathin Copper Oxide: Structure, Electronic Properties, and Reactivity
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Every reference with a DOI in the deposited reference list resolved to a known work in Crossref or DataCite at the dated check, and none carried a retraction, withdrawal, or removal notice.
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The 68 checked references that resolve
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In Situ Scanning Tunneling Microscopy Study of the Anodic Oxidation of Cu(111) in 0.1 M NaOH
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Cu2O as a photocatalyst for overall water splitting under visible light irradiation
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Cu(111) in chloride containing acidic electrolytes: Coadsorption of an oxygenated species
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Structure and composition of Cu(hkl) surfaces exposed to O2 and emersed from alkaline solutions: Prelude to UHV-EC studies of CO2 reduction at well-defined copper catalysts
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In situ STM study of the initial stages of oxidation of Cu(111) in aqueous solution
resolves10.1021/acs.jpcc.9b04856
In Situ EC-STM Study and DFT Modeling of the Adsorption of Glycerol on Cu(111) in NaOH Solution
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The structural analysis of Cu(111)-Te <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si18.gif" overflow="scroll"><mml:mfenced open="(" close=")"><mml:mrow><mml:msqrt><mml:mn>3</mml:mn></mml:msqrt><mml:mo>×</mml:mo><mml:msqrt><mml:mn>3</mml:mn></mml:msqrt></mml:mrow></mml:mfenced></mml:math>R30° and <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si19.gif" overflow="scroll"><mml:mfenced open="(" close=")"><mml:mrow><mml:mn>2</mml:mn><mml:msqrt><mml:mn>3</mml:mn></mml:msqrt><mml:mo>×</mml:mo><mml:mn>2</mml:mn><mml:msqrt><mml:mn>3</mml:mn></mml:msqrt></mml:mrow></mml:mfenced></mml:math>R30° surface phases by quantitative LEED and DFT
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In situ photoacoustic spectroscopy of thin oxide layers on metal electrodes. Copper in alkaline solution
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Determination of the Cu[sub 2]O Thickness on BTAH-Inhibited Copper by Reconstruction of Auger Electron Spectra
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The investigation of the passive behaviour of copper in weakly acid and alkaline solutions and the examination of the passive film by esca and ISS
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In situ STM study of the duplex passive films formed on Cu(111) and Cu(001) in 0.1 M NaOH
resolves10.1021/acs.jpcc.5b01677
Density Functional Theory Study of Adsorption of Benzotriazole on Cu<sub>2</sub>O Surfaces
resolves10.1016/S0169-4332(98)00668-0
A theoretical study of the H2O and H2S chemisorption on Cu2O(111)
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A computational study on water adsorption on Cu2O(111) surfaces: The effects of coverage and oxygen defect
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Trimethylaluminum and Oxygen Atomic Layer Deposition on Hydroxyl-Free Cu(111)
resolves10.1002/cctc.201501188
Back Cover: Potassium‐Induced Effect on the Structure and Chemical Activity of the Cu<sub><i>x</i></sub>O/Cu(1 1 1) (<i>x</i> ≤ 2) Surface: A Combined Scanning Tunneling Microscopy and Density Functional Theory Study (ChemCatChem 23/2015)
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Structurally Accurate Model for the “29”-Structure of Cu<sub><i>x</i></sub>O/Cu(111): A DFT and STM Study
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CO Adsorption on the “29” Cu<sub><i>x</i></sub>O/Cu(111) Surface: An Integrated DFT, STM, and TPD Study
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Organics on oxidic metal surfaces: a first-principles DFT study of PMDA and ODA fragments on the pristine and mildly oxidized surfaces of Cu(111)
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Autocatalytic Reduction of a Cu<sub>2</sub>O/Cu(111) Surface by CO: STM, XPS, and DFT Studies
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Oxygen adsorption and stability of surface oxides on<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mi>Cu</mml:mi><mml:mo>(</mml:mo><mml:mn>111</mml:mn><mml:mo>)</mml:mo></mml:mrow></mml:math>: A first-principles investigation
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Combining the Physics of Metal/Oxide Heterostructure, Interface Dipole, Band Bending, Crystallography, and Surface State to Understand Heterogeneity Contrast in Oxidation and Corrosion
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Water Adsorption on Cu<sub>2</sub>O(111) Surfaces: A Scanning Tunneling Microscopy Study
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Structural and optical properties of Cu2O crystalline electrodeposited films
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Atomistic Modeling of Corrosion Resistance: A First Principles Study of O<sub>2</sub> Reduction on the Al(111) Surface Covered with a Thin Hydroxylated Alumina Film
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Effects of ring substituents on the protective properties of self-assembled benzenethiols on copper
resolves10.1016/j.apsusc.2019.145132
Adsorption and thermal stability of 2-mercaptobenzothiazole corrosion inhibitor on metallic and pre-oxidized Cu(1 1 1) model surfaces
resolves10.1016/j.corsci.2020.108464
2-Mercaptobenzothiazole corrosion inhibitor deposited at ultra-low pressure on model copper surfaces
resolves10.1016/j.apsusc.2020.146814
2-Mercaptobenzimidazole films formed at ultra-low pressure on copper: adsorption, thermal stability and corrosion inhibition performance
resolves10.1016/j.apsusc.2020.147802
DFT investigation of 2-mercaptobenzothiazole adsorption on model oxidized copper surfaces and relationship with corrosion inhibition
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Performance of the Vienna ab initio simulation package (VASP) in chemical applications
resolves10.1016/0927-0256(96)00008-0
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Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set
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From ultrasoft pseudopotentials to the projector augmented-wave method
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Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
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Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction
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A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
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Effect of van der Waals corrections on DFT-computed metallic surface properties
resolves10.1103/PhysRevB.25.5929
High-pressure x-ray study of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Cu</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>O and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Ag</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>O
resolves10.1016/S0013-4686(02)00826-5
In situ STM study of the effect of chlorides on the initial stages of anodic oxidation of Cu(111) in alkaline solutions
resolves10.3390/met8050310
DFT Study of Azole Corrosion Inhibitors on Cu2O Model of Oxidized Copper Surfaces: I. Molecule–Surface and Cl–Surface Bonding
resolves10.1021/acs.jpcc.7b06361
High-Coverage H<sub>2</sub> Adsorption on the Reconstructed Cu<sub>2</sub>O(111) Surface
resolves10.1103/PhysRevB.67.075102
Charge distribution and chemical bonding in<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Cu</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:math>
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Bulk and surface properties of Cu2O: A first-principles investigation
resolves10.1016/j.susc.2009.04.005
First principles investigation on the stabilization mechanisms of the polar copper terminated Cu2O(111) surface
resolves10.1107/S0108767300010254
Topological analyses of cuprite, Cu<sub>2</sub>O, using high-energy synchrotron-radiation data
resolves10.1002/qua.560520204
Quantum chemical calculation of nickel and copper atomic valencies in crystalline oxides
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Exploiting Covalency to Enhance Metal–Oxide and Oxide–Oxide Adhesion at Heterogeneous Interfaces
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Fundamental studies about the interaction of water with perfect, oxygen-vacancy and pre-covered oxygen Cu2O(1 1 1) surfaces: Thermochemistry, barrier, product
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no DOI — not checkedIntroduction to Solid State Physics
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