Crystalsim - X-ray diffraction {hkl} planes simulation

About Crystalsim

Designed this computer simulation program coded in Python back-end, MS-VS front-end to determine the {h , k, l} Miller indices / family planes with reference to diffraction angle (2θ) for all the 7 types of crystal systems. 


Crystallographic Information File (.cif) can also be used.

Crystal lattice parameters such as ‘a’, ‘b’, ‘c’ as well as interfacial angles such as alpha, beta, gamma can also be entered manually, if .cif file is not available.

Processed data can be saved as .csv file. 
Indexed at the International Union of Crystallography (IUCR). 

Crystalsim can be downloaded from here.

Designed by:

Dr. M Kanagasabapathy, Associate Professor

Department of Chemistry, Rajus’ College,

Madurai Kamaraj University

Rajapalayam, (TN) INDIA 626117