Our software:
- SIMAN (a set of Python tools for high-througput DFT calculations and their analysis)
- GB (C++ tool for construction of grain boundaries in metals)
- Diffraction (C++ and Fortran tool for constructing theorectical electronogramms of crystal structures)
Friendly software:
- BVlain (Python tool for making bond valence analysis in crystal structures and determine percolation barriers of ionic conuction)
Other software knowledgebase:
