* XRDCalculator now supports disordered structures. * Minor speed ups and improvements.
2.9.8
Not secure
* Initial beta version of XRD pattern calculator. * Pymatgen now uses spglib 1.6.0. * Update to Vasprun to compute static deilectric constants with DFPT in VASP. (Geoffroy Hautier)
2.9.7
Not secure
* Quick bug-fix release that provides a better solution to Structure handling of properties instead of sanitizing MPRester structures.
2.9.6
Not secure
* Patch to allow 1D phase diagrams (essentially finding the lowest energy phase). * Better error checking for Bandstructure KPOINTs. * Patch to sanitize structures obtained from MPRester.
2.9.5
Not secure
* Bug fix for linear assignment, which may sometimes affect Structure Matcher results. * Minor improvement to the way grand canonical PDs work.
2.9.4
Not secure
* Bug fix for Pourbaix Maker (Sai). * Streamline use of scratch directories for various calls. Require monty >= 0.1.2. * High accuracy mode for Zeo++ (Bharat Medasani).