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RESEARCH PAPER · ACS Nano · 2024

How to Correctly Analyze 2p X-ray Photoelectron Spectra of 3d Transition-Metal Oxides: Pitfalls and Principles

Qiyang Lu

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How to Correctly Analyze 2p X-ray Photoelectron Spectra of 3d Transition-Metal Oxides: Pitfalls and PrinciplesOriginalDecoding Air-Induced Degradation Pathways in O3-Type Layered NaNi1/3Fe1/3Mn1/3O2 for Sodium-Ion Batteries0Integrating Multiple Strategies Using Biotechnology to Design High‐Performance Electrocatalysts for Hydrogen and Oxygen Evolution12A‐Site Regulated (PrBa) x Co 1.5 Fe 0.5 O 6−δ Double Perovskite Oxides: Highly Active and Durable Electrocatalysts for the Enhanced Oxygen Evolution Reaction4Isolated Ni Atoms for Enhanced Photocatalytic H2O2 Performance with 1.05% Solar-to-Chemical Conversion Efficiency in Pure Water25p-d orbital hybridization induced by CuGa2 promotes selective N2 electroreduction4Hierarchical nanostructures of Co(OH)2 on electrospun NiMoO4 nanofibers: Controllable hydrothermal-fabrication and enhanced supercapacitor performance13Engineering lattice strain in bimetallic nanostructures to modulate peroxymonosulfate activation pathways2Photoemission spectroscopy of battery materials5Bimetallic Mesoporous MCM-41 Nanoparticles with Ta/(Ti, V, Co, Nb) with Catalytic and Photocatalytic Properties8Recycling of valuable metals from spent ternary Li-ion batteries for the multi-active site electrocatalysts with high-entropy coordination9Band-edge alignment in InAs1-xSbx photocathodes enabling selective solar-driven CO2-to-liquid conversion0High-efficiency oxygen evolution catalysts: composite hexagonal structure SrCo 1− y Ni y O 3− δ /Sr 9 Ni 7 O 213In situ construction of a built-in electric field for efficient CO 2 electroreduction4Metal–organic frameworks built from a carborane linker isolating ideal one-dimensional large-spin chains of Co ( S = 3/2) or Ni ( S = 1)4Operando APXPS for direct probing of Li ion battery LCO electrode/electrolyte interface chemistry during lithiation/delithiation12Promoted surface reconstruction of amorphous nickel boride electrocatalysts by boron dissolution for boosting the oxygen evolution reaction27Room Temperature Wet CO Oxidation over Delafossite-based AgOx/Ag2CuMnO4 Catalyst0Sn-doped Co–P-based trifunctional electrocatalysts for accelerating water splitting and hydrogen generation concurrent with ethylene glycol electrooxidation7Spin chemistry: the key to revolutionizing energy storage and conversion efficiency8High-performance aqueous asymmetric supercapacitor based on a composite cathode composed of MnCo2O4 and CoMnP48Well-constructed CeO2-coated CuBi2O4 heterojunction: Enhanced charge carriers transportation7Substrate-Dependent Optical Blue-Shift upon F Incorporation in Oxyfluoride SrCo(O,F)3–x Films1Investigation of Electronic Energy Levels in a Weak Ferromagnetic Oxygen‐Deficient BiFeO 2.85 Thick Film Using Absorption and X‐Ray Photoelectron Spectroscopic Studies4Quantifying Dynamic Changes of Oxygen Nonstoichiometry and Formation of Surface Phases of SrCoOx Electrocatalysts by Operando Characterizations10Bipyridine‐Fe (III)–Based Covalent Organic Frameworks for Efficient Photocatalytic Synthesis of Benzimidazoles5Towards Absolute Energy Referencing in XPS5Highly improved electrochemical performance of MnFe2O4 electrode via Mn2O3 addition for supercapacitor applications5Electrocatalytic benchmarking of ruthenium-based bimetallic anodes for the electrocatalytic oxidation of biomass-derived wastewater2Enhanced Ni–Co redox dynamics in dual-SDA engineered ZIF-67 derivatives for high-performance supercapacitors: Insights from operando X-ray spectroscopy13Mechanically-milled YBaCo4O7+ for oxygen sorbents: insights into oxygen contamination and surface structure0Progressive degradation and regeneration pathways in O3-NaNi1/3Fe1/3Mn1/3O2 under long-term low-humidity air exposure8Redox-active Ni-doped g-C₃N₄-Cu₃V₄S₈ nanocomposite for battery-type hybrid supercapacitors24Machine-learning-enabled discovery of gas-sensing descriptors of chemiresistive sensors: A case study of heterojunction2Electrochemical nitrate reduction to ammonia using Fe-doped TiO2 nanoparticles as electrocatalysts: The synergistic contribution from Fe and oxygen vacancy11Quenching-induced Fe doping on spent cathode materials enhances the oxygen evolution reaction performance8Amorphous/crystalline HTiNbO5-X membranes for efficient confined flow synthesis of acetate ester flavours5Application of machine learning on quantitative XPS analysis for heteroatoms (F, La and N) Alloyed HfO2 thin film4Spectroscopic insights into electrochemical activation of pristine TiO2 for enhanced selective oxygen reduction reaction0Surface or Bulk? Mechanistic Insights into Ni2+-Doped Brookite TiO2 Photocatalysts2Magnetoelectrodeposited Co‐Ni Electrocatalyst on Fe‐Modified Ni‐Foam for Alkaline Oxygen Evolution Reaction4Unveiling the influence of electrolyte pH on the structural evolution of cobalt oxide pre-catalyst in oxygen evolution reaction5Toolkit for spectral and multivariate statistical analysis of XPEEM images for studying composite energy materials2Best Practice of Identifying Chemical Constituents and Evolution of Sn-Containing Perovskites by Photoelectron Spectroscopy4Direct Electrosynthesis of C 3+ Hydrocarbons from CO 2 via Size-Controlled Nickel Nanoislands on a Carbon Support13The impact of chlorine-based disinfection on the corrosion behavior of cast iron pipes in water distribution systems2Tailored periodic iron-copper bimetallic domains with zoned activation and modulation effects driving ammonia electrosynthesis6Engineering the Electronic Localization of Metastable Fe 2+ ‐O‐Co 3+ Bimetallic Sites for Superior Electrochemical Ammonia Production11Quantifying and Inhibiting Manganese Dissolution in Li-Rich Mn-Based Cathode Materials36Modulating Interfacial Potential Gradients in Metal−Carbon Catalysts via Phase‐Engineering for Lithium–Sulfur Batteries5Integrated Experimental and Theoretical Insights into Defect‐Induced Functionalities of Cobalt Doped NiO for Multifunctional Solar‐Driven Applications6K-promoted perovskite-derived iron-based catalysts for selective hydrogenation of CO2 to light olefins4Unraveling the role of potassium in the deactivation of nitrogen-doped Mn-containing semi-coke catalysts for low-temperature NH3-SCR: Evidence from acidity, redox properties, and DFT insights2Hf-doped Na4MnCr(PO4)3 for high-voltage and ultra-stable sodium-ion storage0Enhanced electrochemical performance of composite strontium titanate/graphite oxide (STO/GO) hybrid electrodes for supercapacitor2Dynamic redox chemistry overrides insulator-to-metal transition control of illuminated methane oxidation over La 1− x Sr x CoO 3− δ perovskites0Effect of Cobalt Concentration on the Optical Band Gap of Co-Doped TiO2 Thin Films0Isolation of a trigonal bipyramidal Mn( ii ) diradical complex with an intermediate spin state ( S = 3/2)0Revealing the direct role of cobalt in oxygen evolution reaction initiation over high-performance iridium-cobalt oxide catalysts2Synergistic Enhancement of Fe-Co-La Amorphous Aerogels Catalytic Performance for Oxygen Evolution Reaction through Nitrogen-Doped Graphdiyne Integration: A Combined DFT Prediction and Experimental Validation0Tuning the charge distribution of Co–N–C active sites for enhanced trifunctional electrocatalysis0X-ray photoelectron spectroscopy analysis of reference compounds for studying rechargeable Li-, Na-, and K-ion batteries8Band-edge alignment in ultra-narrow InAs1-xSbx photocathodes enabling selective solar-driven CO2-to-liquid conversion2Pre-calcination time tuning: A Key to unlock high-performance Li-rich cathodes via biphase regulation0Cobalt Precursor as Surface Inhibitor for Area-Selective Atomic Layer Deposition of Nanoscale Electronic Interconnects0Room temperature wet CO oxidation over delafossite-based AgOx/Ag2CuMnO4 catalyst0Stabilizing amorphous (Mn,Co,Zn)Ox porous nanosheet cathodes with Ag nanodots for efficient energy storage2Cobalt hydroxide to ZIF-67: A novel water-based electrochemical deposition0Spin-mediated and proton-coupled electron transfer boost NADH oxidase-like activity of dual-atom metallozymes1Synergistic co-preintercalation of nickel and aluminum ions into vanadium oxide hydrate as positive electrode material in ultrahigh-rate and high-capacity aqueous zinc-ion batteries3UV-Induced Enhancement of Acid Sites on Fly ash@TiO2 Photocatalysts for Continuous Ammonia Oxidation with Mechanistic Insights0Impact of potassium doping on the physical properties of cadmium sulfide thin films prepared by sol-gel screen printing technique3Interface-type resistive switching in sodium ion-doped AlOx memristors for neuromorphic computing0Multi-modal characterization of nitrate reduction nano-catalysts with periodic strain distribution2Tuning oxygen content via La3+ incorporation to enhance structural and electrical transport properties of Sr0.725Y0.275CoO3-δ0Effects of the Annealing Process and Sb Doping on the Microstructure, Thermoelectric Performance, and Mechanical Processability of β -FeSi 21Enhancing the electrochemical performance of a binary nanocomposite by incorporation of nickel ions for asymmetric supercapacitor applications0V 2 O 5 Interfacial Passivation with 2H–MoSe 2 Nanostructures for Ion Intercalation and Diffusion-Driven Charge Storage in Symmetric Supercapacitors2Facile green synthesis of GaFeO3 nanoparticles using Mitragyna speciosa leaf extract: Structural, optical, and morphological properties0Synergistic interfacial passivation of dye-sensitized solar cell photoanodes using Myristica fragrans pulp-derived carbon dots and Ag nanoparticles1Compositional complexity in a 2D transition metal oxide1Electronic Structure Reorganization in MPS 3 via d‐Shell‐Selective Alkali Metal Doping3Engineering a Ga-Mn-Zr trimetallic oxide to modulate intermediates for highly selective light olefin synthesis from syngas0Synergistic Schottky junction and p–n heterojunction in Pd-BiOBr/CuBi2O4 for enhanced CO2 photocatalytic performance: A combined experimental and DFT study16Role of Cocatalyst on Sn‐Doped Hematite Photoanodes for Photoelectrochemical Glycerol Oxidation: Enhancing the Selectivity Toward C 3 Molecules in Alkaline pH0Bromine-triggered anion redox and strain buffering boost layered oxide cathodes for sodium-ion batteries8Harnessing the Co-Fe synergy: A novel Co-doped FeOCl for peracetic acid activation to efficiently degrade carbamazepine2Synergistic modulation of the crystal structure, electronic band structure and luminescence in Al3+ co-doped LiMgBO3:Dy3+toward single host white phosphors1Na-rich and high-voltage Na3V2(PO4)3/C cathode actualizes high-energy-density sodium-ion battery4Formation process of Fe-Mn Co-precipitates and Its implications for U(VI) immobilization: Mechanisms and environmental factors0Strain-Regulated Lattice Integrated with a Self-Purifying Interface for Ultra-Stable O3-Type Sodium Cathodes0The Influence of the Co/Cu Ratio and Organic Ligand in MOF/ Copper Phthalocyanine‐Derived Tandem Electrocatalysts on the Electrocatalytic Nitrate Reduction Reaction2Ultrahigh-current-density Fe-doped NiCr layered double hydroxide as a robust bifunctional electrocatalyst for overall water splitting and alkaline seawater electrolysis25Tuning the Water Reactivity of LaCoO 3 Surfaces by Subsurface Engineering0Carbon nano-confined NiCo/NiCo2O4@C as a high performance anode material for sodium-ion batteries2Acid–Base Matching at Kaolin‐Regulated Interfaces for Efficient Photocatalytic Degradation of Phenol0Effect of cobalt concentration on structural and optical band gap of TiO2/CoOX thin films1Effect of Cu doping on the catalytic performance of Ni-Cu electrodes for alkaline water electrolysis2From a Mott–Anderson Insulator to an Itinerant Metal in LaCo 1– x Ni x O 3 : Charge Transfer, Spin-State Percolation, and Lattice Control1Electronic Blockade of Shunting Pathways via Dual Insulator Contacts for High-Efficiency Wide-Bandgap Perovskite Indoor Photovoltaics0Co-doping and oxygen vacancy enabled spin engineering in FeCu-layered double hydroxides for ultra-efficient Peroxymonosulfate activation toward rapid tetracycline degradation0Constructing a CoP/Ni2P heterostructure within porous intercalated flower-like bimetallic phosphides to enhance the dehydrogenation performance of LiBH40Surface La Vacancy-Induced Activating Surface Lattice Oxygen of LaFeO 3 for Boosting Formaldehyde Sensing Performance0Remodified Ni/Al 2 O 3 Catalysts for the Gas-Phase Reductive Amination of 1-Octanol: Reconfiguration of Acid–Base Sites Enhances Catalytic Performance0Stabilizing Electrochemical Interfaces With Multifunctional Cobalt Nitride Layers1Potassium-driven tuning of α-MnO2 tunnel structures for soot oxidation0Effect of B-site Ta doping on the structure and electrochemical performance of LaBaFe2-xTaxO5+δ (x = 0–0.4) cathodes for intermediate-temperature solid oxide fuel cells0Electronic Structure Engineering of Bimetallic Wolframites: Synergistic Ni-Doped and Ag-Decorated Cobalt Tungstate Nanoparticles for Bifunctional Oxygen Electrocatalysis0All-carbon 3D-structured electrodes by direct ink writing as electrocatalyst supports for alkaline freshwater and seawater electrolysis0Characterization and Application of Pr–Co Codoped BiFeO 3 for Cr(VI) Reduction in the Process of Visible-Light Photocatalysis0Modulated Interphase Chemistry Unlocks Ultra‐Stable Ni‐Rich Single‐Crystal Cathode in Sulfide All‐Solid‐State Batteries0Suppression of photocatalysis in ceria-rutile nanocomposites: the role of surface structure and properties0Rationalizing the Hydrogen Uptake–Release Balance in AB2 Alloys via d-Band Center Evolution0Polystyrene-templated low-temperature Fe3O4-to-Fe5C2 carburization: Steering nanostructure for selective CO2 hydrogenation to light olefins0Engineering Multicationic Pathways for Next-Gen Dielectric and Thermistor Applications0Crystal Domain Engineering of Ni‐based Co‐Free Layered Cathodes for High‐Performance Li‐Ion Batteries1Narrowband Far-Red Emitting Sr2ZnAl22O36:Mn4+ Spinel Phosphor for Integrated Horticultural LED, Optical Thermometry, and Forensic Fingerprint Imaging0High Spin Manganese Boosting Photo‐Magnetic Catalytic Hydrogen Evolution Over Covalent Organic Frameworks1Near-complete extraction of V and Mo from refractory smelting slag via ultrasound-assisted sodium persulfate leaching: Process optimization, kinetics and synergistic mechanisms1The Plant‐to‐Plant Circular Strategy: Coupling Photodegradation and Phytoremediation With Plant‐Based Nanomaterials for Plastic Degradation0Entropy‐Engineered Multi‐Metallic MOFs Unlock High‐Performance Ammonium‐Ion Storage0Realization of hydrogen-associated magnetoelectric phase modulations in brownmillerite strontium ferrite with vertically aligned oxygen vacancy channels0Durable, Binder‐Free MoO 3 /Fe 2 O 3 /MoS 2 Honeycomb Heterostructure for Light‐Enhanced Water Splitting at Industrial Current Density0Water-flow-induced rapid directional electron transfer via Mo-S-Fe bridge bonds for enhanced Fe(III)/Fe(II) redox cycling in Fenton-like system1Ascorbate-Promoted Whole-Cell Biocatalysis for Lithium Bio-Recovery from Spent LiFePO4 Cathodes0Electrical potential regulated water-based lubrication on copper alloy surfaces0Tuning a built-in electric field on CeF3/Ni3S2 catalysts for enhanced alcohol electrooxidation0Coupled Defect Chemistry and Surface Electrostatics Modulate Rare-Earth Upconversion Kinetics in Oxide Thin Films0Bi- and tri-metal LDH films on stainless steel mesh for optimized interfacial kinetics in alkaline oxygen evolution0Chemical evolution of DMC-diesel soot during oxidation: Effects of NO concentration on surface and bulk functional groups0Intramolecular Charge Transfer-Boosted π–π Stacking for Rapid Screening of the d Electron Number in Transition Metals0A three-dimensional open framework phosphate host for potassium-ion battery anodes0Signal-on/off colorimetric detection of H2O2 and glutathione using a Fe/Mn bimetallic nanozyme with tunable d–d orbital hybridization0Dual-mode operation of solution-combustion-derived nonstoichiometric PrNi0.5Co0.5O3−δ oxygen electrode for direct 8YSZ-based RSOFCs1Local basicity engineering via BaO/CuO interfaces enables efficient CO₂ electroreduction to C2+ products0Pressure-Regulated Enzyme-Equivalent Strontium Cobalt Oxide “Perovzymes” with Phase-Dependent Activity0Reductive Reconstruction Activates High‐Entropy Perovskite Fiber–ZnIn 2 S 4 Interfaces in Photocatalytic Hydrogen Evolution and Solar Water Evaporation0Surface-engineered Co60Fe15B21Ti4 metallic glass ribbons with hierarchical porosity for durable and recoverable peroxymonosulfate activation in wastewater treatment0Interfacial Engineering of Redox-Active Covalent Organic Frameworks/Graphene Hybrids for High-Performance Supercapacitors0Fe–gallic acid metal–phenolic network redox mediator supports concurrent nitrate reduction and sulfamethoxazole attenuation0Enhancement of the synergy between high-spin sites for efficient oxygen electrocatalysis0

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