An efficient way of including thermal diffuse scattering in simulation of scanning transmission electron microscopic images

被引:18
作者
Croitoru, M. D. [1 ]
Van Dyck, D. [1 ]
Van Aert, S. [1 ]
Bals, S. [1 ]
Verbeeck, J. [1 ]
机构
[1] Univ Antwerp, EMAT, B-2020 Antwerp, Belgium
关键词
scanning transmission electron microscopy (STEM); thermal diffuse scattering; multislice simulation;
D O I
10.1016/j.ultramic.2006.04.006
中图分类号
TH742 [显微镜];
学科分类号
摘要
We propose an improved image simulation procedure for atomic-resolution annular dark-field scanning transmission electron microscopy (STEM) based on the multislice formulation, which takes thermal diffuse scattering fully into account. The improvement with regard to the classical frozen phonon approach is realized by separating the lattice configuration statistics from the dynamical scattering so as to avoid repetitive calculations. As an example, the influence of phonon scattering on the image contrast is calculated and investigated. STEM image simulation of crystals can be applied with reasonable computing times to problems involving a large number of atoms and thick or large supercells. (c) 2006 Elsevier B.V. All rights reserved.
引用
收藏
页码:933 / 940
页数:8
相关论文
共 49 条
[1]   Lattice-resolution contrast from a focused coherent electron probe. Part I [J].
Allen, LJ ;
Findlay, SD ;
Oxley, MP ;
Rossouw, CJ .
ULTRAMICROSCOPY, 2003, 96 (01) :47-63
[2]   DELOCALIZATION IN ELECTRON-IMPACT IONIZATION IN A CRYSTALLINE ENVIRONMENT [J].
ALLEN, LJ ;
ROUSSOUW, CJ .
PHYSICAL REVIEW B, 1993, 47 (05) :2446-2452
[3]   Theory of lattice resolution in high-angle annular dark-field images [J].
Amali, A ;
Rez, P .
MICROSCOPY AND MICROANALYSIS, 1997, 3 (01) :28-46
[4]  
Bethe H, 1928, ANN PHYS-BERLIN, V87, P55
[5]   Quantification of high-resolution electron microscope images of amorphous carbon [J].
Boothroyd, CB .
ULTRAMICROSCOPY, 2000, 83 (3-4) :159-168
[6]   Quantification of lattice images: the contribution from diffuse scattering [J].
Boothroyd, CB .
JOURNAL OF ELECTRON MICROSCOPY, 2002, 51 :S279-S287
[7]   Atomic configurations and energetics of arsenic impurities in a silicon grain boundary [J].
Chisholm, MF ;
Maiti, A ;
Pennycook, SJ ;
Pantelides, ST .
PHYSICAL REVIEW LETTERS, 1998, 81 (01) :132-135
[8]   INELASTIC-SCATTERING OF HIGH-ENERGY ELECTRONS IN REAL SPACE [J].
COENE, W ;
VANDYCK, D .
ULTRAMICROSCOPY, 1990, 33 (04) :261-267
[9]   THE SCATTERING OF ELECTRONS BY ATOMS AND CRYSTALS .1. A NEW THEORETICAL APPROACH [J].
COWLEY, JM ;
MOODIE, AF .
ACTA CRYSTALLOGRAPHICA, 1957, 10 (10) :609-619
[10]  
*D REID PUBL CO, 1983, INT TABL CRYST