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RESEARCH PAPER · Surface Science · 2011

The (2×2) reconstructions on the SrTiO3 (001) surface: A combined scanning tunneling microscopy and density functional theory study

Yuyuan Lin, Andres E. Becerra-Toledo, Fabien Silly, Kenneth Reinhard Poeppelmeier, Martin R. Castell, Laurence D. Marks

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The (2×2) reconstructions on the SrTiO3 (001) surface: A combined scanning tunneling microscopy and density functional theory studyOriginalSurface Stabilization Mechanisms in Metal Oxides1Fixed-Point Optimization of Atoms and Density in DFT57Synthesis-Dependent Atomic Surface Structures of Oxide Nanoparticles59Influence of the Metal Oxide Substrate Structure on Vanadium Oxide Monomer Formation10Stoichiometry-driven switching between surface reconstructions on SrTiO3(001)48Bonding at Oxide Surfaces4Epitaxial Growth Process of La0.7Ca0.3MnO3 Thin Films on SrTiO3(001): Thickness-Dependent Inhomogeneity Caused by Excess Ti Atoms14A Quantitative Structural Investigation of the 0.1 wt % Nb–SrTiO3(001)/H2O Interface14Electron-induced Ti-rich surface segregation on SrTiO3 nanoparticles15Intrinsic origin of two-dimensional electron gas at the (001) surface of SrTiO 332The effect of oxygen vacancies on the electronic structures, magnetic properties and the stability of SrTiO3(001) surface9Molecular Beam Epitaxy Growth and Scanning Tunneling Microscopy Study of Pyrite CuSe 2 Films on SrTiO 34Structural distortion and charge redistribution in SrTiO 3 (111) polar surfaces15Noncontact Atomic Force Microscope Dissipation Reveals a Central Peak of SrTiO3 Structural Phase Transition24NOx Adsorption on ATiO3(001) Perovskite Surfaces11Observation of a two-dimensional liquid of Fröhlich polarons at the bare SrTiO3 surface180When does atomic resolution plan view imaging of surfaces work?4Monolayer FeSe on SrTiO3183Atomic-scale visualization of initial growth of perovskites on SrTiO3(001) using scanning tunneling microscope23Atomically flat single terminated oxide substrate surfaces110Controlling the magnetism of oxygen surface vacancies in SrTiO 3 through charging22Ab initio Calculations of YAlO3 and ABO3 Perovskite (001), (011) and (111) Surfaces, Interfaces and Defects0Single-layer TiOx reconstructions on SrTiO3 (111): (√7 × √7)R19.1°, (√13 × √13)R13.9°, and related structures13Mechanical dissipation from charge and spin transitions in oxygen-deficient SrTiO3 surfaces27Ab Initio Predictions of Double-Layer TiO 2 -Terminated SrTiO 3 (001) Surface Reconstructions19Pauling's rules for oxide surfaces44Ab initio calculations of CaZrO3, BaZrO3, PbTiO3 and SrTiO3 (001), (011) and (111) surfaces as well as their (001) interfaces19How heteroepitaxy occurs on strontium titanate25Evaporation-induced self-assembly of C 60 on SrTiO 3 (110) reconstructed surfaces1Suspended single-crystalline oxide structures on silicon through wet-etch techniques: Effects of oxygen vacancies and dislocations on etch rates11Systematic trends in YAlO3, SrTiO3, BaTiO3, BaZrO3 (001) and (111) surface ab initio calculations16Surfaces of Bulk Oxides2Understanding the interplay of surface structure and work function in oxides: A case study on SrTiO354Ab initio calculations of ABO3 perovskite (001), (011) and (111) nano-surfaces, interfaces and defects16Nature of the surface space charge layer on undoped SrTiO 3 (001)19RETRACTED ARTICLE: Atom-vacancy hopping in ultra-high vacuum at room temperature in SrTiO3 (001)2The role of surfaces in flexoelectricity20The interface of in-situ grown single-layer epitaxial MoS2 on SrTiO3(001) and (111)4Work Function: Fundamentals, Measurement, Calculation, Engineering, and Applications209Critical behavior in the epitaxial growth of two-dimensional tellurium films on SrTiO3 (001) substrates9Critical behavior in the epitaxial growth of two-dimensional tellurium films on SrTiO3 (001) substrates0Phase and stoichiometry control in superconducting FeSe layers on SrTiO31A -site adatoms stabilize A B O 3 ( 001 ) surface reconstructions0

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  1. Surface Stabilization Mechanisms in Metal Oxides

    Unknown journal · 2011-07-01

    Becerra Toledo, Andres Enrique

    Read original paper ↗ ·

  2. Fixed-Point Optimization of Atoms and Density in DFT

    Journal of Chemical Theory and Computation · 2013-04-30

    Laurence D. Marks

    Read original paper ↗ ·

  3. Synthesis-Dependent Atomic Surface Structures of Oxide Nanoparticles

    Physical Review Letters · 2013-10-08

    Yuyuan Lin, Jianguo Wen, Linhua Hu, Robert M. Kennedy, Peter Curran Stair, Kenneth Reinhard Poeppelmeier, Laurence D. Marks

    Read original paper ↗ ·

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

    Topics in Catalysis · 2013-10-16

    Alexis M. Johnson, Brian R. Quezada, Laurence D. Marks, Peter Curran Stair

    Read original paper ↗ ·

  5. Stoichiometry-driven switching between surface reconstructions on SrTiO3(001)

    Surface Science · 2013-10-26

    Stefan Gerhold, Zhiming Wang, Michael Schmid, Ulrike Diebold

    Read original paper ↗ ·

  6. Bonding at Oxide Surfaces

    Structure and bonding · 2014-01-01

    James A. Enterkin, Kenneth Reinhard Poeppelmeier

    Read original paper ↗ ·

  7. Epitaxial Growth Process of La0.7Ca0.3MnO3 Thin Films on SrTiO3(001): Thickness-Dependent Inhomogeneity Caused by Excess Ti Atoms

    Crystal Growth & Design · 2014-02-14

    Ryota Shimizu, Takeo Ohsawa, Katsuya Iwaya, Susumu Shiraki, Taro Hitosugi

    Read original paper ↗ ·

  8. A Quantitative Structural Investigation of the 0.1 wt % Nb–SrTiO3(001)/H2O Interface

    The Journal of Physical Chemistry C · 2014-04-23

    Hadeel Hussain, X. Torrelles, Parasmani Rajput, Marco Nicotra, Geoff Thornton, Jörg Zegenhagen

    Read original paper ↗ ·

  9. Electron-induced Ti-rich surface segregation on SrTiO3 nanoparticles

    Micron · 2014-06-02

    Yuyuan Lin, Jianguo Wen, Linhua Hu, James A. McCarthy, Shichao Wang, Kenneth Reinhard Poeppelmeier, Laurence D. Marks

    Read original paper ↗ ·

  10. Intrinsic origin of two-dimensional electron gas at the (001) surface of SrTiO 3

    Physical Review B · 2015-03-26

    Pietro Delugas, Vincenzo Fiorentini, Alessandro Mattoni, Alessio Filippetti

    Read original paper ↗ ·

  11. The effect of oxygen vacancies on the electronic structures, magnetic properties and the stability of SrTiO3(001) surface

    Surface Science · 2015-05-16

    Yanli Li, Dian-Na Zhang, Shaobo Qu, Ming Yang, Yuan Ping Feng

    Read original paper ↗ ·

  12. Molecular Beam Epitaxy Growth and Scanning Tunneling Microscopy Study of Pyrite CuSe 2 Films on SrTiO 3

    Chinese Physics Letters · 2015-06-01

    Junping Peng, Huimin Zhang, Can‐Li Song, Yeping Jiang, Lili Wang, Ke He, Qi‐Kun Xue, Xu-Cun Ma

    Read original paper ↗ ·

  13. Structural distortion and charge redistribution in SrTiO 3 (111) polar surfaces

    Vacuum · 2015-06-23

    Yan Hong Yin, Jianli Wang, Huiping Zhu, Kai Lv, Xingcai Wu

    Read original paper ↗ ·

  14. Noncontact Atomic Force Microscope Dissipation Reveals a Central Peak of SrTiO3 Structural Phase Transition

    Physical Review Letters · 2015-07-20

    Marcin Kisiel, Franco Pellegrini, Giuseppe E. Santoro, Markus Samadashvili, Rémy Pawlak, Andrea Benassi, Urs Gysin, Renato Buzio, Andrea Gerbi, Ernst Meyer, Erio Tosatti

    Read original paper ↗ ·

  15. NOx Adsorption on ATiO3(001) Perovskite Surfaces

    The Journal of Physical Chemistry C · 2015-07-21

    Brita Abrahamsson, Henrik J. Grönbeck

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  16. Observation of a two-dimensional liquid of Fröhlich polarons at the bare SrTiO3 surface

    Nature Communications · 2015-10-22

    Kai Chen, José Avila, E. Frantzeskakis, Anna Levy, M. C. Asensio

    Read original paper ↗ ·

  17. When does atomic resolution plan view imaging of surfaces work?

    Ultramicroscopy · 2016-08-06

    Pratik Koirala, Yuyuan Lin, Jim Ciston, Laurence D. Marks

    Read original paper ↗ ·

  18. Monolayer FeSe on SrTiO3

    Annual Review of Condensed Matter Physics · 2017-03-31

    Dennis Huang, Jennifer E. Hoffman

    Read original paper ↗ ·

  19. Atomic-scale visualization of initial growth of perovskites on SrTiO3(001) using scanning tunneling microscope

    Current Applied Physics · 2017-04-02

    Young Jun Chang, Soo‐hyon Phark

    Read original paper ↗ ·

  20. Atomically flat single terminated oxide substrate surfaces

    Progress in Surface Science · 2017-05-01

    Abhijit Biswas, Chan-Ho Yang, Ramamoorthy Ramesh, Yoon H. Jeong

    Read original paper ↗ ·

  21. Controlling the magnetism of oxygen surface vacancies in SrTiO 3 through charging

    Physical Review Materials · 2017-09-25

    Oleg O. Brovko, Erio Tosatti

    Read original paper ↗ ·

  22. Ab initio Calculations of YAlO3 and ABO3 Perovskite (001), (011) and (111) Surfaces, Interfaces and Defects

    Unknown journal · 2018-01-01

    Roberts I. Eglitis, Anatoli I. Popov

    Read original paper ↗ ·

  23. Single-layer TiOx reconstructions on SrTiO3 (111): (√7 × √7)R19.1°, (√13 × √13)R13.9°, and related structures

    Surface Science · 2018-04-24

    Tassie K. Andersen, Shuqiu Wang, Martin R. Castell, Dillon D. Fong, Laurence D. Marks

    Read original paper ↗ ·

  24. Mechanical dissipation from charge and spin transitions in oxygen-deficient SrTiO3 surfaces

    Nature Communications · 2018-07-23

    Marcin Kisiel, Oleg O. Brovko, Dilek Yıldız, Rémy Pawlak, Urs Gysin, Erio Tosatti, Ernst Meyer

    Read original paper ↗ ·

  25. Ab Initio Predictions of Double-Layer TiO 2 -Terminated SrTiO 3 (001) Surface Reconstructions

    The Journal of Physical Chemistry C · 2018-09-04

    Seyoung Cook, Laurence D. Marks

    Read original paper ↗ ·

  26. Pauling's rules for oxide surfaces

    Surface Science Reports · 2018-09-11

    Tassie K. Andersen, Dillon D. Fong, Laurence D. Marks

    Read original paper ↗ ·

  27. Ab initio calculations of CaZrO3, BaZrO3, PbTiO3 and SrTiO3 (001), (011) and (111) surfaces as well as their (001) interfaces

    Integrated ferroelectrics · 2019-02-12

    Roberts I. Eglitis

    Read original paper ↗ ·

  28. How heteroepitaxy occurs on strontium titanate

    Science Advances · 2019-04-05

    Seyoung Cook, Kendra Letchworth‐Weaver, I‐Cheng Tung, Tassie K. Andersen, Hawoong Hong, Laurence D. Marks, Dillon D. Fong

    Read original paper ↗ ·

  29. Evaporation-induced self-assembly of C 60 on SrTiO 3 (110) reconstructed surfaces

    Nanotechnology · 2019-07-10

    Chengguang Yue, Pan Ying, Bo Xu, Yongjun Tian

    Read original paper ↗ ·

  30. Suspended single-crystalline oxide structures on silicon through wet-etch techniques: Effects of oxygen vacancies and dislocations on etch rates

    Journal of Vacuum Science & Technology A Vacuum Surfaces and Films · 2019-12-27

    Zheng Hui Lim, Matthew Chrysler, Abinash Kumar, Jacob P. Mauthe, Divine P. Kumah, Chris Richardson, James M. LeBeau, Joseph H. Ngai

    Read original paper ↗ ·

  31. Systematic trends in YAlO3, SrTiO3, BaTiO3, BaZrO3 (001) and (111) surface ab initio calculations

    International Journal of Modern Physics B · 2019-12-30

    Roberts I. Eglitis, Juris Purans, Anatoli I. Popov, Ran Jia

    Read original paper ↗ ·

  32. Surfaces of Bulk Oxides

    Springer handbooks · 2020-01-01

    Jacques Jupille

    Read original paper ↗ ·

  33. Understanding the interplay of surface structure and work function in oxides: A case study on SrTiO3

    APL Materials · 2020-07-01

    Tianyu Ma, Ryan M. Jacobs, John H. Booske, Dane D. Morgan

    Read original paper ↗ ·

  34. Ab initio calculations of ABO3 perovskite (001), (011) and (111) nano-surfaces, interfaces and defects

    Modern Physics Letters B · 2020-07-06

    Roberts I. Eglitis, S. P. Kruchinin

    Read original paper ↗ ·

  35. Nature of the surface space charge layer on undoped SrTiO 3 (001)

    Journal of Materials Chemistry C · 2021-01-01

    Hojoon Lim, Chanyang Song, Minsik Seo, Dongwoo Kim, Moonjung Jung, Habin Kang, Seung‐Hwan Kim, Kyungjae Lee, Youngseok Yu, Geonhwa Kim, Ki-Jeong Kim, Bongjin Simon Mun

    Read original paper ↗ ·

  36. RETRACTED ARTICLE: Atom-vacancy hopping in ultra-high vacuum at room temperature in SrTiO3 (001)

    Applied Physics A · 2021-01-16

    Rasheed Atif

    Read original paper ↗ ·

  37. The role of surfaces in flexoelectricity

    Journal of Applied Physics · 2021-06-11

    Christopher A. Mizzi, Laurence D. Marks

    Read original paper ↗ ·

  38. The interface of in-situ grown single-layer epitaxial MoS2 on SrTiO3(001) and (111)

    Journal of Physics Condensed Matter · 2023-02-24

    Mark J. Haastrup, Marco Bianchi, L. Lammich, Jeppe Vang Lauritsen

    Read original paper ↗ ·

  39. Work Function: Fundamentals, Measurement, Calculation, Engineering, and Applications

    Physical Review Applied · 2023-03-22

    Lin Lin, Ryan M. Jacobs, Tianyu Ma, Dongzheng Chen, John H. Booske, Dane D. Morgan

    Read original paper ↗ ·

  40. Critical behavior in the epitaxial growth of two-dimensional tellurium films on SrTiO3 (001) substrates

    Chinese Physics B · 2023-03-28

    Haimin Zhang, Dezhi Song, Fuyang Huang, Jun Zhang, Yeping Jiang

    Read original paper ↗ ·

  41. Critical behavior in the epitaxial growth of two-dimensional tellurium films on SrTiO3 (001) substrates

    Chinese Physics B · 2023-05-01

    Haimin Zhang, Dezhi Song, Fuyang Huang, Jun Zhang, Yeping Jiang

    Read original paper ↗ ·

  42. Phase and stoichiometry control in superconducting FeSe layers on SrTiO3

    Journal of Materials Science · 2024-02-01

    Maria Hilse, Forrest Brown, Joseph Roth, Simon Munyan, Roman Engel‐Herbert

    Read original paper ↗ ·

  43. A -site adatoms stabilize A B O 3 ( 001 ) surface reconstructions

    Physical review. B./Physical review. B · 2026-07-29

    Siyu Wu, Chao He, Linzhe Tang, Shaogang Xu, Hu Xu

    Read original paper ↗ ·
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