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RESEARCH PAPER · Nature Materials · 2010

A homologous series of structures on the surface of SrTiO3(110)

James A. Enterkin, Arun K. Subramanian, Bruce C. Russell, Martin R. Castell, Kenneth Reinhard Poeppelmeier, Laurence D. Marks

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A homologous series of structures on the surface of SrTiO3(110)OriginalA Chemical Approach to Understanding Oxide Surface Structure and Reactivity4Structure, stability and work functions of the low index surfaces of pure indium oxide and Sn-doped indium oxide (ITO) from density functional theory218UNIVERSIDADE ESTADUAL PAULISTA DOUTORADO EM CIÊNCIA E TECNOLOGIA DE MATERIAIS CAMPUS DE BAURU1Surface science goes inorganic17Modelagem em simulação computacional do cristal e superfícies do BaZr'O IND. 3' e SrZr"O IND. 3'0Thermodynamic and kinetic properties of hydrogen defect pairs in SrTiO3 from density functional theory18Universal Ti-rich termination of atomically flat SrTiO3 (001), (110), and (111) surfaces138Ab initio charge analysis of pure and hydrogenated perovskites17Oriented Catalytic Platinum Nanoparticles on High Surface Area Strontium Titanate Nanocuboids121Evolution of the surface structures on SrTiO 3 (110) tuned by Ti or Sr concentration62Propane Oxidation over Pt/SrTiO3 Nanocuboids166Vacant-Site Octahedral Tilings on SrTiO 3 (001), the ( 13 × 13 ) R 33.7 ° Surface, and Related Structures93Being Quantitative in Reciprocal Space0Reversible Transition between Thermodynamically Stable Phases with Low Density of Oxygen Vacancies on the SrTiO3(110) Surface34Surface and Defect Structure of Oxide Nanowires on SrTiO 336Epitaxial BaTiO3(100) films on Pt(100): A low-energy electron diffraction, scanning tunneling microscopy, and x-ray photoelectron spectroscopy study15Guided growth of Ag nanoparticles on SrTiO3 (110) surface12A chemical approach to understanding oxide surfaces44Electrostatic stability of insulating surfaces: Theory and applications64Ab Initio Calculations of SrTiO3 (111) Surfaces3Surface transmission electron diffraction for SrTiO3 surfaces22Cation stoichiometry optimization of SrTiO3 (110) thin films with atomic precision in homogeneous molecular beam epitaxy20The Silica–Water Interface: How the Silanols Determine the Surface Acidity and Modulate the Water Properties467Nanosession: 2D Electron Systems ‐ Correlation Effects and Transport0Comparative ab initio calculations of SrTiO3 and CaTiO3 polar (111) surfaces38Electronic structures of the SrTiO3(110) surface in different reconstructions11Bonding and structure of a reconstructed (001) surface of SrTiO3 from TEM111Ab initio calculations of the atomic and electronic structure of BaZrO3 (111) surfaces62Growth of SrTiO3(110) film by oxide molecular beam epitaxy with feedback control14Nanostructured Nd0.45Sr0.55MnO3 films grown on SrTiO3(110)4Reconstructions on SrTiO3(111) surface tuned by Ti/Sr deposition30SrTiO3 (001) surface and strained thin films: Atomic simulations using a tight-binding variable-charge model16Strain-Induced Defect Superstructure on the SrTiO3(110) Surface36Initial growth stages of titanium and barium oxide films on SrTiO3(001)11Influence of the Metal Oxide Substrate Structure on Vanadium Oxide Monomer Formation10Pauling's third rule beyond the bulk: chemical bonding at quartz-type GeO 2 surfaces19Water Adsorption at the Tetrahedral Titania Surface Layer of SrTiO3(110)-(4 × 1)46Bonding at Oxide Surfaces4The Roles of Reduced Ti Cations and Oxygen Vacancies in Water Adsorption and Dissociation on SrTiO3(110)40Anisotropic two-dimensional electron gas at SrTiO 3 (110)123Titanium enrichment and strontium depletion near edge dislocation in strontium titanate [001]/(110) low-angle tilt grain boundary30Ab initio calculations of SrTiO 3, BaTiO 3, PbTiO 3, CaTiO 3, SrZrO 3, PbZrO 3 and BaZrO 3 (001), (011) and (111) surfaces as well as F centers, polarons, KTN solid solutions and Nb impurities therein110Coexisting Surface Phases and Coherent One-Dimensional Interfaces on BaTiO3(001)24Morphological studies of Ni clusters on SrTiO3 (001) and (110)5Facet-Specific Assembly of Proteins on SrTiO3 Polyhedral Nanocrystals43Hybrid functionals applied to perovskites147Structure and reactivity of zero-, two- and three-dimensional Pd supported on SrTiO3(001)5Vacancy clusters at domain boundaries and band bending at the SrTiO3(110) surface20Stabilizing Single Ni Adatoms on a Two-Dimensional Porous Titania Overlayer at the SrTiO3(110) Surface18Colloquium : Emergent properties in plane view: Strong correlations at oxide interfaces272Wulff shape of strontium titanate nanocuboids21Surface reconstructions in molecular beam epitaxy of SrTiO347Lanthanum aluminate (110) 3 × 1 surface reconstruction16Imaging the Evolution of d States at a Strontium Titanate Surface207.4.4 The surfaces of cubic perovskites0Defects on Strontium Titanate16Precise control of LaTiO3(110) film growth by molecular beam epitaxy and surface termination of the polar film2Synergistic Oxygen Evolving Activity of a TiO 2 -Rich Reconstructed SrTiO 3 (001) Surface69Orientation-dependent growth of Ni clusters on SrTiO3 (001), (110), and (111) surfaces1Transition from Order to Configurational Disorder for Surface Reconstructions on SrTiO3 (111)42Comparative First-Principles Calculations of SrTiO3, BaTiO3, PbTiO3 and CaTiO3 (001), (011) and (111) Surfaces49Nickel-Oxide-Modified SrTiO3(110)-(4 × 1) Surfaces and Their Interaction with Water16Real-Time Observation of Reconstruction Dynamics on TiO2(001) Surface under Oxygen via an Environmental Transmission Electron Microscope127Insulating oxide surfaces and nanostructures10Complex surface structure of (110) terminated strontium titanate nanododecahedra19Iron oxide surfaces611Transition from Reconstruction toward Thin Film on the (110) Surface of Strontium Titanate37Adjusting island density and morphology of the SrTiO3(110)-(4 × 1) surface: Pulsed laser deposition combined with scanning tunneling microscopy27Interface induced high temperature superconductivity in single unit-cell FeSe on SrTiO3(110)183Microscopic characterization of Fe nanoparticles formed on SrTiO3(001) and SrTiO3(110) surfaces1Formation of Sr adatom chains on SrTiO 3 (1 1 0) surface determined by strain1Density functional calculations of a staggered FeSe monolayer on a SrTiO3 (110) surface4Towards spin-polarized two-dimensional electron gas at a surface of an antiferromagnetic insulating oxide8Enhancement of orbital ordering and spin polarization by controlling the dimensionality of the octahedra network15Surface magnetism of strontium titanate73Surface and Interface Aspects of Organometal Halide Perovskite Materials and Solar Cells210In-situ real-space imaging of single crystal surface reconstructions via electron microscopy17Entropic contributions enhance polarity compensation for CeO2(100) surfaces121Investigation of Electronic Structures of SrTiO3(001) Surface with N Adsorption by First-Principles3Anisotropy of infrared-active phonon modes in the monodomain state of tetragonal SrTiO3 (110)7Surface reconstructions and related local properties of a BiFeO3 thin film24First‐Principles Investigation of the Relevant Surfaces Exposed by Polycrystalline LaFeO 311Surface Atomic Structure Directs the Fate of Human Mesenchymal Stem Cells23Atomically flat single terminated oxide substrate surfaces110δ-Doping of oxygen vacancies dictated by thermodynamics in epitaxial SrTiO3 films10Utilizing High-temperature Atomic-resolution STEM and EELS to Determine Reconstructed Surface Structure of Complex Oxide0Stability and Decomposition of Perovskite-Type Titanates upon High-Temperature Reduction20Reentrance of low-temperature nonmetallic phase of La2/3Sr1/3MnO3 (110) thin films7Electronic structure modification of the KTaO3 single-crystal surface by Ar+ bombardment36Polaron-Driven Surface Reconstructions63Structure Sensitivity of Acrolein Hydrogenation by Platinum Nanoparticles on BaxSr1−xTiO3 Nanocuboids9Surface, final state, and spin effects in the valence-band photoemission spectra of LaCoO3 (001)6Shape Effect Undermined by Surface Reconstruction: Ethanol Dehydrogenation over Shape-Controlled SrTiO3 Nanocrystals71Unveiling the Atomic Structures of the Minority Surfaces of TiO2 Nanocrystals28Optical Anisotropy of SrTiO3(110) for Different Surface Terminations5Self-Assembled Barium Titanate Nanoscale Films by Molecular Beam Epitaxy0All Roads Lead to TiO2: TiO2-Rich Surfaces of Barium and Strontium Titanate Prepared by Hydrothermal Synthesis36Controlled growth of complex polar oxide films with atomically precise molecular beam epitaxy15Morphology and CO Oxidation Activity of Pd Nanoparticles on SrTiO3 Nanopolyhedra46Single-layer TiOx reconstructions on SrTiO3 (111): (√7 × √7)R19.1°, (√13 × √13)R13.9°, and related structures13Crystal Orientation-Dependent Reactivity of Oxide Surfaces in Contact with Lithium Metal14In‐Situ Annealing of the (110) and (001) Surfaces of SrTiO3 Nanocuboids by High‐Resolution Transmission Electron Microscopy1Pauling's rules for oxide surfaces44Subsurface reconstruction and saturation of surface bonds19Combining the Physics of Metal/Oxide Heterostructure, Interface Dipole, Band Bending, Crystallography, and Surface State to Understand Heterogeneity Contrast in Oxidation and Corrosion17Epitaxial Growth of Monolayer MoS2 on SrTiO3 Single Crystal Substrates for Applications in Nanoelectronics50Thermal Degradation of Monolayer MoS2 on SrTiO3 Supports29Pushing the detection of cation nonstoichiometry to the limit23Direct observation of atomic-scale fracture path within ceramic grain boundary core48Surface Reconstructions of SrTiO3(110) Calibrated with STM and LEED3Evaporation-induced self-assembly of C 60 on SrTiO 3 (110) reconstructed surfaces1Encapsulation of Metal Oxide Nanoparticles by Oxide Supports during Epitaxial Growth3Ab initio calculations of CaZrO3 (011) surfaces: systematic trends in polar (011) surface calculations of ABO3 perovskites45A solid-state chemist’s eye for the development of materials science in China5Epitaxial growth of complex oxide films: Role of surface reconstructions12Atomically resolved surface phases of La 0.8 Sr 0.2 MnO 3 (110) thin films22Metallic behavior in STO/LAO heterostructures with non-uniformly atomic interfaces4Flexible Cation Distribution for Stabilizing a Spinel Surface12Surface termination and stoichiometry of LaAlO3(001) surface studied by HRTEM15Comparative Ab Initio Calculations of ReO3, SrZrO3, BaZrO3, PbZrO3 and CaZrO3 (001) Surfaces52Surface Refaceting Mechanism on Cubic Ceria81Predictive Mixing for Density Functional Theory (and Other Fixed-Point Problems)15First principles studies of the electronic and structural properties of the rutile VO2(110) surface and its oxygen-rich terminations5Two-dimensional surface phase diagram of a multicomponent perovskite oxide: La0.8Sr0.2MnO3(110)7Facet‐Dependent Surface Charge and Hydration of Semiconducting Nanoparticles at Variable pH71Surprising stability of polar (001) surfaces of the Mott insulator GdTiO32Oxygen-rich tetrahedral surface phase on high-temperature rutile VO2(110)T single crystals9Neural-network-backed evolutionary search for SrTiO 3 (110) surface reconstructions23Ab Initio Computations of O and AO as well as ReO2, WO2 and BO2-Terminated ReO3, WO3, BaTiO3, SrTiO3 and BaZrO3 (001) Surfaces46Structural Shrinking and Rotation Decrease Quasi Surface Tension for Polar CeO2(100)4An introduction to the theory of inorganic solid surfaces2Enhanced metal exsolution at the non-polar (001) surfaces of multi-faceted epitaxial thin films4Oxide Surfaces1Evolution of the surface atomic structure of multielement oxide films: curse or blessing?1Atomic reconstructions and dynamic-evolutionary pathways on a model polar surface of ionic crystal0Chemical Trends of Surface Reconstruction and Band Positions of Nonmetallic Perovskite Oxides from First Principles20Anomalous intense coherent secondary photoemission from a perovskite oxide19Ordered Electronic Reconstruction of the (112¯0$11\bar{2}0$) ZnO Single Crystal0Enhancing the Electrochemical Properties of Nickel-Rich Cathode by Surface Coating with Defect-Rich Strontium Titanate23Direct Observation of Atomic Step‐Assisted Stabilization of Polar Surfaces2Small polaron formation on the Nb-doped SrTiO3 (001) surface11Dual-modification of Ni-rich cathode materials through strontium titanate coating and thermal treatment36Environmentally Stable p(6 × 2) SrTiO3(001) Surface Reconstruction with Low-Valent Ti for Photocatalytic Water Splitting4Traces of Potassium Induce Restructuring of the Anatase TiO2(001)-(1×4) Surface from a Reactive to an Inert Structure4Controlling surface reconstruction of SrTiO3(100) with adhesive outgassing5Hydrogen-mediated polarity compensation on the (110) surface terminations of ABO3 perovskites1Atomic reconstructions and dynamic-evolutionary pathways on a polar surface of a wurtzite ionic crystal: Ga-doped ZnO(0001)0Review of Systematic Tendencies in (001), (011) and (111) Surfaces Using B3PW as Well as B3LYP Computations of BaTiO3, CaTiO3, PbTiO3, SrTiO3, BaZrO3, CaZrO3, PbZrO3 and SrZrO3 Perovskites103Accelerating the prediction of inorganic surfaces with machine learning interatomic potentials23Exploring inhomogeneous surfaces: Ti-rich SrTiO 3 (110) reconstructions via active learning7

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  1. A Chemical Approach to Understanding Oxide Surface Structure and Reactivity

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  2. Structure, stability and work functions of the low index surfaces of pure indium oxide and Sn-doped indium oxide (ITO) from density functional theory

    Journal of Materials Chemistry · 2010-01-01

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  3. UNIVERSIDADE ESTADUAL PAULISTA DOUTORADO EM CIÊNCIA E TECNOLOGIA DE MATERIAIS CAMPUS DE BAURU

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  4. Surface science goes inorganic

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  5. Modelagem em simulação computacional do cristal e superfícies do BaZr'O IND. 3' e SrZr"O IND. 3'

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  6. Thermodynamic and kinetic properties of hydrogen defect pairs in SrTiO3 from density functional theory

    Physical Chemistry Chemical Physics · 2011-01-01

    Nicolai Bork, Nikolaos Bonanos, Jan Rossmeisl, Tejs Vegge

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  7. Universal Ti-rich termination of atomically flat SrTiO3 (001), (110), and (111) surfaces

    Applied Physics Letters · 2011-01-31

    A. Biswas, Pim B. Rossen, Chan‐Ho Yang, Wolter Siemons, Myung‐Hwa Jung, I. K. Yang, R. Ramesh, Yoon Hee Jeong

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  8. Ab initio charge analysis of pure and hydrogenated perovskites

    Journal of Applied Physics · 2011-02-01

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  9. Oriented Catalytic Platinum Nanoparticles on High Surface Area Strontium Titanate Nanocuboids

    Nano Letters · 2011-02-02

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  10. Evolution of the surface structures on SrTiO 3 (110) tuned by Ti or Sr concentration

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  11. Propane Oxidation over Pt/SrTiO3 Nanocuboids

    ACS Catalysis · 2011-04-28

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  12. Vacant-Site Octahedral Tilings on SrTiO 3 (001), the ( 13 × 13 ) R 33.7 ° Surface, and Related Structures

    Physical Review Letters · 2011-04-29

    Danielle M. Kienzle, Andres E. Becerra-Toledo, L. D. Marks

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  13. Being Quantitative in Reciprocal Space

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  14. Reversible Transition between Thermodynamically Stable Phases with Low Density of Oxygen Vacancies on the SrTiO3(110) Surface

    Physical Review Letters · 2011-07-14

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  15. Surface and Defect Structure of Oxide Nanowires on SrTiO 3

    Physical Review Letters · 2011-08-16

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  16. Epitaxial BaTiO3(100) films on Pt(100): A low-energy electron diffraction, scanning tunneling microscopy, and x-ray photoelectron spectroscopy study

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  17. Guided growth of Ag nanoparticles on SrTiO3 (110) surface

    The Journal of Chemical Physics · 2011-10-11

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  18. A chemical approach to understanding oxide surfaces

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  19. Electrostatic stability of insulating surfaces: Theory and applications

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  20. Ab Initio Calculations of SrTiO3 (111) Surfaces

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  21. Surface transmission electron diffraction for SrTiO3 surfaces

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  22. Cation stoichiometry optimization of SrTiO3 (110) thin films with atomic precision in homogeneous molecular beam epitaxy

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  23. The Silica–Water Interface: How the Silanols Determine the Surface Acidity and Modulate the Water Properties

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  24. Nanosession: 2D Electron Systems ‐ Correlation Effects and Transport

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  25. Comparative ab initio calculations of SrTiO3 and CaTiO3 polar (111) surfaces

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  26. Electronic structures of the SrTiO3(110) surface in different reconstructions

    The Journal of Chemical Physics · 2012-07-23

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  27. Bonding and structure of a reconstructed (001) surface of SrTiO3 from TEM

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  28. Ab initio calculations of the atomic and electronic structure of BaZrO3 (111) surfaces

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  29. Growth of SrTiO3(110) film by oxide molecular beam epitaxy with feedback control

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  30. Nanostructured Nd0.45Sr0.55MnO3 films grown on SrTiO3(110)

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  32. SrTiO3 (001) surface and strained thin films: Atomic simulations using a tight-binding variable-charge model

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  33. Strain-Induced Defect Superstructure on the SrTiO3(110) Surface

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  34. Initial growth stages of titanium and barium oxide films on SrTiO3(001)

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  35. Influence of the Metal Oxide Substrate Structure on Vanadium Oxide Monomer Formation

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  36. Pauling's third rule beyond the bulk: chemical bonding at quartz-type GeO 2 surfaces

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  37. Water Adsorption at the Tetrahedral Titania Surface Layer of SrTiO3(110)-(4 × 1)

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  38. Bonding at Oxide Surfaces

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  39. The Roles of Reduced Ti Cations and Oxygen Vacancies in Water Adsorption and Dissociation on SrTiO3(110)

    The Journal of Physical Chemistry C · 2014-01-20

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  40. Anisotropic two-dimensional electron gas at SrTiO 3 (110)

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  41. Titanium enrichment and strontium depletion near edge dislocation in strontium titanate [001]/(110) low-angle tilt grain boundary

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  42. Ab initio calculations of SrTiO 3, BaTiO 3, PbTiO 3, CaTiO 3, SrZrO 3, PbZrO 3 and BaZrO 3 (001), (011) and (111) surfaces as well as F centers, polarons, KTN solid solutions and Nb impurities therein

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  43. Coexisting Surface Phases and Coherent One-Dimensional Interfaces on BaTiO3(001)

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    Erie H. Morales, John Mark P. Martirez, Wissam Abdo Saidi, Andrew M. Rappe, Dawn A. Bonnell

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  44. Morphological studies of Ni clusters on SrTiO3 (001) and (110)

    Applied Surface Science · 2014-05-20

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  45. Facet-Specific Assembly of Proteins on SrTiO3 Polyhedral Nanocrystals

    Scientific Reports · 2014-05-28

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  46. Hybrid functionals applied to perovskites

    Journal of Physics Condensed Matter · 2014-05-29

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  47. Structure and reactivity of zero-, two- and three-dimensional Pd supported on SrTiO3(001)

    Surface Science · 2014-07-01

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  48. Vacancy clusters at domain boundaries and band bending at the SrTiO3(110) surface

    Physical Review B · 2014-07-23

    Zhiming Wang, Xianfeng Hao, Stefan Gerhold, Michael Schmid, Cesare Franchini, Ulrike Diebold

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  49. Stabilizing Single Ni Adatoms on a Two-Dimensional Porous Titania Overlayer at the SrTiO3(110) Surface

    The Journal of Physical Chemistry C · 2014-08-02

    Zhiming Wang, Xianfeng Hao, Stefan Gerhold, Petr Mareš, M. Wagner, Roland Bliem, Karina Schulte, Michael Schmid, Cesare Franchini, Ulrike Diebold

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  50. Colloquium : Emergent properties in plane view: Strong correlations at oxide interfaces

    Reviews of Modern Physics · 2014-10-13

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