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Interplay between strain, defect charge state, and functionality in complex oxides

https://doi.org/10.1063/1.4958716
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/adma.201101152openalex-snapshot
Structure and Properties of Functional Oxide Thin Films: Insights From Electronic‐Structure Calculations
inferredcites →https://doi.org/10.1002/pssb.201046289openalex-snapshot
Electrostatic interactions between charged defects in supercells
inferredcites →https://doi.org/10.1016/0927-0256(96)00008-0openalex-snapshot
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
inferredcites →https://doi.org/10.1016/j.commatsci.2014.12.030openalex-snapshot
Chemical expansion affected oxygen vacancy stability in different oxide structures from first principles calculations
inferredcites →https://doi.org/10.1021/cm2030608openalex-snapshot
Anisotropic Thermal and Chemical Expansion in Sr-Substituted LaMnO3+δ: Implications for Chemical Strain Relaxation
inferredcites →https://doi.org/10.1021/nn304930xopenalex-snapshot
Beyond Condensed Matter Physics on the Nanoscale: The Role of Ionic and Electrochemical Phenomena in the Physical Functionalities of Oxide Materials
inferredcites →https://doi.org/10.1038/nature13918openalex-snapshot
Artificial chemical and magnetic structure at the domain walls of an epitaxial oxide
inferredcites →https://doi.org/10.1038/nnano.2015.108openalex-snapshot
Strain-induced coupling of electrical polarization and structural defects in SrMnO3 films
inferredcites →https://doi.org/10.1038/srep16977openalex-snapshot
Self-regulation of charged defect compensation and formation energy pinning in semiconductors
inferredcites →https://doi.org/10.1103/physrevb.47.558openalex-snapshot
Ab initio molecular dynamics for liquid metals
inferredcites →https://doi.org/10.1103/physrevb.49.14251openalex-snapshot
Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
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.78.235104openalex-snapshot
Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs
inferredcites →https://doi.org/10.1103/physrevb.85.214120openalex-snapshot
Incipient ferroelectricity in 2.3 % tensile-strained CaMnO 3 films
inferredcites →https://doi.org/10.1103/physrevb.87.014403openalex-snapshot
Effects of strain on ferroelectric polarization and magnetism in orthorhombic HoMnO 3
inferredcites →https://doi.org/10.1103/physrevb.88.054111openalex-snapshot
Strain-controlled oxygen vacancy formation and ordering in CaMnO 3
inferredcites →https://doi.org/10.1103/physrevb.90.085202openalex-snapshot
Vacancies and small polarons in SrTiO 3
inferredcites →https://doi.org/10.1103/physrevb.92.054103openalex-snapshot
Effect of epitaxial strain on cation and anion vacancy formation in MnO
inferredcites →https://doi.org/10.1103/physrevlett.100.136406openalex-snapshot
Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces
inferredcites →https://doi.org/10.1103/physrevlett.102.016402openalex-snapshot
Fully Ab Initio Finite-Size Corrections for Charged-Defect Supercell Calculations
inferredcites →https://doi.org/10.1103/physrevlett.102.117602openalex-snapshot
Engineering Multiferroism in CaMnO3
inferredcites →https://doi.org/10.1103/physrevlett.104.207204openalex-snapshot
Epitaxial-Strain-Induced Multiferroicity in SrMnO 3 from First Principles
inferredcites →https://doi.org/10.1103/physrevlett.112.087202openalex-snapshot
Insulating Ferromagnetic LaCoO3−δ Films: A Phase Induced by Ordering of Oxygen Vacancies
inferredcites →https://doi.org/10.1103/revmodphys.86.253openalex-snapshot
First-principles calculations for point defects in solids
inferredcites →https://doi.org/10.1107/s0567739476001551openalex-snapshot
Revised effective ionic radii and systematic studies of interatomic distances in halides and chalcogenides
inferredcites →https://doi.org/10.1111/j.1151-2916.2001.tb00968.xopenalex-snapshot
Chemical Expansivity of Electrochemical Ceramics
inferredcites →https://doi.org/10.1126/science.1243098openalex-snapshot
Functional Ion Defects in Transition Metal Oxides

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Green Synthesis of Highly Defective Nanostructured Fe-Doped SnO2: Magnetic and Photocatalytic Properties Evaluation
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The Misfit Dislocation Core Phase in Complex Oxide Heteroepitaxy
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La‐YFeO 3 Perovskite/PVDF‐HFP Composite Based High Performance Triboelectric Energy Harvester for Self‐Powered Insole Applications
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Linearity Improvement of TiO x ‐Based Flexible Memristor Synapses Even Under Bending
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Impact of A-Site Doping on Structural, Electrical and Magnetic Analysis of Bi1.8Pr0.2FeCrO6 Double Perovskite
inferred← citeshttps://doi.org/10.1016/j.actamat.2024.120194openalex-snapshot
Green-assisted synthesis of highly defective nanostructured Fe-doped SnO2: Magnetic and photocatalytic properties evaluation
inferred← citeshttps://doi.org/10.1016/j.jeurceramsoc.2021.07.010openalex-snapshot
Influence of tensile vs. compressive stress on fatigue of lead zirconate titanate thin films
inferred← citeshttps://doi.org/10.1016/j.jeurceramsoc.2022.12.052openalex-snapshot
Increased fatigue resistance in transparent lead zirconate titanate thin films with interdigitated electrodes
inferred← citeshttps://doi.org/10.1016/j.jmat.2025.101158openalex-snapshot
One-step sintering enabled structural stability and defect suppression even in Fe-off-stoichiometric BiFeO3BaTiO3 piezoceramics
inferred← citeshttps://doi.org/10.1016/j.jmmm.2019.01.115openalex-snapshot
Evaluation of the relationship between the magnetism and the optical properties in SrTiO3-δ defective systems: Experimental and theoretical studies
inferred← citeshttps://doi.org/10.1021/acs.jpcc.9b00411openalex-snapshot
Unraveling the Charge State of Oxygen Vacancies in ZrO2–x on the Basis of Synergistic Computational and Experimental Evidence
inferred← citeshttps://doi.org/10.1021/acsami.7b11034openalex-snapshot
Ablation Behavior of Plasma-Sprayed La1–xSrxTiO3+δ Coating Irradiated by High-Intensity Continuous Laser
inferred← citeshttps://doi.org/10.1038/s41586-020-1980-yopenalex-snapshot
Hidden diversity of vacancy networks in Prussian blue analogues
inferred← citeshttps://doi.org/10.1038/s41598-021-93968-1openalex-snapshot
Anisotropic chemical expansion due to oxygen vacancies in perovskite films
inferred← citeshttps://doi.org/10.1039/c6cp08315copenalex-snapshot
Strain effects on oxygen vacancy energetics in KTaO 3
inferred← citeshttps://doi.org/10.1039/c8tc06608fopenalex-snapshot
Bi vacancy formation in BiFeO 3 epitaxial thin films under compressive (001)-strain from first principles
inferred← citeshttps://doi.org/10.1039/c9cp00923jopenalex-snapshot
Optical revelation of defects in epitaxial barium titanate films
inferred← citeshttps://doi.org/10.1039/d0cp03644gopenalex-snapshot
In situ anion-doped epitaxial strontium titanate films
inferred← citeshttps://doi.org/10.1039/d1ta08407kopenalex-snapshot
Chemical lattice strain in nonstoichiometric oxides: an overview
inferred← citeshttps://doi.org/10.1039/d1tc02317aopenalex-snapshot
Ferroelectricity promoted by cation/anion divacancies in SrMnO 3
inferred← citeshttps://doi.org/10.1039/d1tc04969kopenalex-snapshot
Strain enhancement due to oxygen vacancies in perovskite oxide films
inferred← citeshttps://doi.org/10.1063/5.0007209openalex-snapshot
Multiple optical impacts of anion doping in epitaxial barium titanate films
inferred← citeshttps://doi.org/10.1063/5.0077043openalex-snapshot
First-principles study of oxygen vacancy formation in strained oxides
inferred← citeshttps://doi.org/10.1103/6y99-279qopenalex-snapshot
Local indirect magnetoelectric coupling at twin walls in CaMnO 3
inferred← citeshttps://doi.org/10.1103/k155-1t97openalex-snapshot
Impact of graphene encapsulation on thermodynamics of quantum emitters in hexagonal boron nitride
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Characterizing the Charge Trapping across Crystalline and Amorphous Si/SiO 2 /HfO 2 Stacks from First-Principle Calculations
inferred← citeshttps://doi.org/10.1103/physrevb.101.094106openalex-snapshot
Charge transport in epitaxial barium titanate films
inferred← citeshttps://doi.org/10.1103/physrevb.108.054441openalex-snapshot
Direct experimental evidence of tunable charge transfer at the LaNiO3/CaMnO3 ferromagnetic interface
inferred← citeshttps://doi.org/10.1103/physrevb.99.094102openalex-snapshot
Self-consistent site-dependent DFT+ U study of stoichiometric and defective SrMnO3
inferred← citeshttps://doi.org/10.1103/physrevb.99.144428openalex-snapshot
First-principles investigations of the magnetic phase diagram of Gd1−xCaxMnO3
inferred← citeshttps://doi.org/10.1103/physrevmaterials.8.055801openalex-snapshot
Epitaxial strain-tuned oxygen vacancy formation, reduction behavior, and electronic structure of perovskite SrIrO3
inferred← citeshttps://doi.org/10.1103/physrevresearch.2.023056openalex-snapshot
Oxygen vacancy dipoles in strained epitaxial BaTiO3 films
inferred← citeshttps://doi.org/10.1103/physrevresearch.2.042040openalex-snapshot
Local polarization in oxygen-deficient LaMnO3 induced by charge localization in the Jahn-Teller distorted structure
inferred← citeshttps://doi.org/10.1103/physrevresearch.3.033237openalex-snapshot
Interplay between polarization, strain and defect-pairs in Fe-doped SrMnO$_{3-\delta}$
inferred← citeshttps://doi.org/10.1103/physrevresearch.6.l022055openalex-snapshot
Assessing the potential of perfect screw dislocations in SiC for solid-state quantum technologies
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Structural and magnetic properties of epitaxially strained (001)- and (111)-oriented Pb 2 CoTeO 6 from first-principles
inferred← citeshttps://doi.org/10.1109/tuffc.2020.2978901openalex-snapshot
Conductivity in Ferroelectric Barium Titanate: Electrons Versus Oxygen Vacancies
inferred← citeshttps://doi.org/10.2139/ssrn.5390828openalex-snapshot
Enhanced Piezoelectricity of Bifeo3-Batio3 Ceramics: Low-Temperature Sintering and Defect Suppression
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