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用于通过布洛赫波方法模拟具有吸收的三维会聚束图案的FORTRAN源列表。

FORTRAN source listing for simulating three-dimensional convergent beam patterns with absorption by the Bloch wave method.

作者信息

Zuo J M, Gjonnes K, Spence J C

机构信息

Department of Physics, Arizona State University, Tempe 85287.

出版信息

J Electron Microsc Tech. 1989 May;12(1):29-55. doi: 10.1002/jemt.1060120105.

Abstract

The FORTRAN source code is given for a computer program that calculates the two-dimensional intensity distribution in convergent-beam transmission electron microdiffraction (CBED) patterns from perfect crystals. The program uses the eigenvalue or Bloch-wave method. It allows three-dimensional dynamical diffraction, and so includes all higher-order Laue zone effects without approximation. No symmetry reduction is included. The program accepts noncentrosymmetric or centrosymmetric crystal structures and allows absorption corrections to be included. It uses the "EISPACK" subroutines for the diagonalisation of a general complex matrix. Up to 100 CBED disks may be included. The code is also available via "Bitnet."

摘要

给出了一个Fortran源代码,用于一个计算机程序,该程序可计算完美晶体的会聚束透射电子微衍射(CBED)图案中的二维强度分布。该程序使用本征值或布洛赫波方法。它允许三维动态衍射,因此无需近似即可包含所有高阶劳厄区效应。不包括对称性简化。该程序接受非中心对称或中心对称晶体结构,并允许包含吸收校正。它使用“EISPACK”子程序对一般复矩阵进行对角化。最多可包含100个CBED盘。该代码也可通过“Bitnet”获得。

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