Materials Algorithms Project Crystallography: Program Library

Complete Program Library

This index contains complete PROGRAMS relating to the modelling of crystallographic phenomena.

Format of documentation within this library.

Programs Available

A

MAP_CRYSTAL_AVIEW

MAP_CRYSTAL_AVIEW is an interactive program which produces pictures of multi-atomic systems and enables the user to rotate and view them from any desired orientation.

Language: Executable program only.

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B

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C

MAP_CRYSTAL_CEMSTRUCT

Calculates the RELATIVE intensities of electron diffraction spots when forming an electron diffraction pattern from a region of cementite (Fe₃C) in a transmission electron microscope.

Language: FORTRAN

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D

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E

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F

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G

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H

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IJ

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K

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L

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M

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N

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O

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PQ

MAP_CRYSTAL_PROGRAM

An interactive program for the analysis of crystal structures.

Language: FORTRAN

MAP_CRYSTAL2_PROGRAM

An interactive program for  analysis of electron diffraction  patterns. Program 'test_precipitates.c'  requires data from a file 'ppt.dat'. This latter file contains a list of possible crystal structures against which electron diffraction data are compared. The program test_precipitates.c also calls the program 'crystal_new.for' to do the analysis. The complete program, is ready for compilation. A form compiled for LINUX is also available for downloading.

Language: C, FORTRAN

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R

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S

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T

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UVW

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XYZ

MAP_CRYSTAL_XRDCALC

Calculation of retained austenite content in a mixture of austenite and ferrite, using X-ray intensity data.

Language: C

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