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Title: Surface determination through atomically resolved secondary-electron imaging

Journal Article · · Nature Communications
DOI:https://doi.org/10.1038/ncomms8358· OSTI ID:1255531
 [1];  [2];  [2];  [3];  [1];  [3];  [4];  [4];  [5];  [2];  [3]
  1. Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
  2. Univ. of Melbourne (Australia)
  3. Northwestern Univ., Evanston, IL (United States)
  4. Hitachi High Technologies Corp., Ibaraki (Japan)
  5. Brookhaven National Lab. (BNL), Upton, NY (United States)

We report that unique determination of the atomic structure of technologically relevant surfaces is often limited by both a need for homogeneous crystals and ambiguity of registration between the surface and bulk. Atomically resolved secondary-electron imaging is extremely sensitive to this registration and is compatible with faceted nanomaterials, but has not been previously utilized for surface structure determination. Here we show a detailed experimental atomic-resolution secondary-electron microscopy analysis of the c(6 x 2) reconstruction on strontium titanate (001) coupled with careful simulation of secondary-electron images, density functional theory calculations and surface monolayer-sensitive aberration-corrected plan-view high-resolution transmission electron microscopy. Our work reveals several unexpected findings, including an amended registry of the surface on the bulk and strontium atoms with unusual seven-fold coordination within a typically high surface coverage of square pyramidal TiO5 units. Lastly, dielectric screening is found to play a critical role in attenuating secondary-electron generation processes from valence orbitals.

Research Organization:
Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Grant/Contract Number:
FG02-01ER45945; DMR-1206320; AC02-05CH11231; AC02-98CH10886
OSTI ID:
1255531
Journal Information:
Nature Communications, Vol. 6; ISSN 2041-1723
Publisher:
Nature Publishing GroupCopyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 29 works
Citation information provided by
Web of Science

References (49)

Imaging single atoms using secondary electrons with an aberration-corrected electron microscope journal September 2009
Image simulation for atomic resolution secondary electron image journal December 2012
Atomic imaging using secondary electrons in a scanning transmission electron microscope: Experimental observations and possible mechanisms journal June 2011
Secondary electron imaging at atomic resolution using a focused coherent electron probe journal February 2013
Reconstructed Surface Structure of (111) Gold Platelets, Observed by High Resolution Techniques journal May 1983
High resolution images of a reconstructed surface structure on (111) gold platelets: Interpretation and comparison with theoretical models journal January 1983
High resolution surface study by In-situ UHV transmission electron microscopy journal January 1982
Imaging the Dimers in Si ( 111 ) ( 7 × 7 ) journal November 1996
Atomic Structure of Si(111)- ( 5 × 2 ) -Au from High Resolution Electron Microscopy and Heavy-Atom Holography journal September 1995
The structure and chemistry of the TiO2-rich surface of SrTiO3 (001) journal September 2002
SrTiO3(001)-c(6 × 2): a long-range, atomically ordered surface stable in oxygen and ambient air journal November 1996
Performance and image analysis of the aberration-corrected Hitachi HD-2700C STEM journal March 2009
Background, status and future of the Transmission Electron Aberration-corrected Microscope project
  • Dahmen, U.; Erni, R.; Radmilovic, V.
  • Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, Vol. 367, Issue 1903, p. 3795-3808 https://doi.org/10.1098/rsta.2009.0094
journal August 2009
EDM 1.0: Electron direct methods journal February 2005
Atomic-scale structure of the Sr Ti O 3 ( 001 ) c ( 6 × 2 ) reconstruction: Experiments and first-principles calculations journal July 2007
Surface Structures of SrTiO 3 (001):  A TiO 2 -rich Reconstruction with a c(4 × 2) Unit Cell journal August 2003
Vacant-Site Octahedral Tilings on SrTiO 3 (001), the ( 13 × 13 ) R 33.7 ° Surface, and Related Structures journal April 2011
c(6×2) and c(4×2) reconstruction of SrTiO 3 (001) journal April 1999
Formation of single-domain anatase TiO2(001)‐(1×4) islands on SrTiO3(001) after thermal annealing journal October 2004
Low electron energy-loss spectroscopy study of the electronic structure of matrix and Σ19, Σ13 boundaries in SrTiO 3 journal January 2005
Synthesis-Dependent Atomic Surface Structures of Oxide Nanoparticles journal October 2013
The chemical bond and atomic displacements in SrTiO3 from X-ray diffraction analysis journal December 1995
Charge density distributions of strontium titanate obtained by the maximum entropy method journal May 1998
Electron-density distribution in cubic SrTiO 3 : a comparative γ-ray diffraction study journal June 2005
Experimental surface charge density of the Si ( 100 ) 2 × 1 H surface journal August 2006
Diffraction refinement of localized antibonding at the Si(111) 7 × 7 surface journal May 2009
Theory of photoemission journal July 1976
Concentric-shell algorithm for Auger and core-level photoelectron diffraction: Theory and applications journal September 1993
Mapping energy bands in layer compounds from the angular dependence of ultraviolet photoemission journal July 1974
Secondary electron emission from tungsten. Observation of the electronic structure of the semi-infinite crystal journal January 1979
Secondary-electron-emission spectroscopy of tungsten: Angular dependence and phenomenology journal November 1978
Electron scattering by atomic hydrogen: Elastic and inelastic phenomena at 13.9–200 eV journal November 1991
Electron scattering by atomic sodium: 3 2 S –3 S 2 and 3 2 S –3 2 P cross sections at 10 to 100 eV journal December 1991
Low-energy elastic scattering of electrons from atomic oxygen journal November 1989
Quantitative electron spectroscopy of surfaces: A standard data base for electron inelastic mean free paths in solids journal February 1979
Determination of the complex dielectric function of epitaxial SrTiO3 films using transmission electron energy-loss spectroscopy journal March 1999
Theory of dielectric screening and electron energy loss spectroscopy at surfaces journal July 2009
Theory and Application for the Scanning Tunneling Microscope journal June 1983
Fixed-Point Optimization of Atoms and Density in DFT journal May 2013
Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces journal April 2008
Comparative assessment of a new nonempirical density functional: Molecules and hydrogen-bonded complexes journal December 2003
Single atom imaging in high-resolution UHV electron microscopy: Bi on Si(111) surface journal August 1992
Edge effects journal September 2002
Retarded field calculation of electron energy loss in inhomogeneous dielectrics journal March 2002
Water-driven structural evolution of the polar MgO (111) surface: An integrated experimental and theoretical approach journal February 2009
Theory of Angular Resolved Photoemission from Adsorbates journal May 1974
Extinction-free electron diffraction refinement of bonding in SrTiO 3 journal August 2004
Electron density and energy density view on the atomic interactions in SrTiO 3 journal July 2002
Atomic Imaging Using Secondary Electrons in a Scanning Transmission Electron Microscope : Experimental Observations and Possible Mechanisms preprint January 2010

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Nanoparticle shape, thermodynamics and kinetics journal January 2016
Surface-screening mechanisms in ferroelectric thin films and their effect on polarization dynamics and domain structures journal January 2018
Exact Time-Dependent Exchange-Correlation Potential in Electron Scattering Processes journal December 2017
How heteroepitaxy occurs on strontium titanate journal April 2019