Heusler Tetragonal Distortion


This page is the front-end to our Heusler database. At present we are interested in the mechanism for the tetragonal distortion that occurs in a few Heuslers, as such the format of the website reflects this. The data is calculated using the VASP implementation of density functional theory (DFT), further details of the calculation can be found here.

Search calculated materials.

New calculations.

element data.

A daily sql dump of the tetragonal database is provided here.

--- Created by Thomas Archer, Trinity College, Dublin ---