Files
lammps/examples/SPIN
Axel Kohlmeyer f052509015 Merge pull request #1421 from julient31/gneb_spin
Adding a GNEB implementation in the SPIN package
2019-04-29 14:14:58 -04:00
..
2019-04-29 08:23:57 -06:00
2019-03-11 13:04:03 -06:00
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2019-03-25 15:43:58 -06:00
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This directory contains examples and applications of the SPIN package
=====================================================================

- the iron, cobalt_hcp, cobalt_fcc and nickel directories provide 
examples of spin-lattice calculations.

- the bfo repository provides an example of spin dynamics calculation
performed on a fixed lattice, and applied to the multiferroic 
material bismuth-oxide. 

- the read_restart directory provides examples allowing to write or 
read data files, and restart magneto-mechanical simulations.  

- vizualization of the dump files can be achieved using Ovito or 
VMD. See the vmd repository for help vizualizing results with VMD. 

** Note, the aim of this repository is mainly to provide users with
examples. Better values and tuning of the magnetic and mechanical 
interactions can be achieved for more accurate materials 
simulations. **