- Fix: increased cut-off to VoronoiNN to avoid scipy crash (@utf)
- Fix: Outcar parsing issues with certain values of electrostatic potential (@sivonxay)
- Fix: bug in EnumlibAdaptor/EnumerateStructureTransformation involving incorrect
stoichiometries in some instances (#1286) (@shyuep) - Fix: fractional co-ordinate finite precision errors in CifParser, now
also includes additional warnings for implicit hydrogens (@mkhorton) - New features and improvements to GBGenerator (@ucsdlxg, @shyuep)
- New analysis options in StructureGraph, speed up tests (@mkhorton)
- New utility function to pretty print disordered formulae, along with a
ordered-to-disordered structure transformation (@mkhorton) - Ability to use pymatgen's StructureMatcher against AFLOW's library of
crystallographic prototypes (@mkhorton) - Make Chgcar serializable to/from dict for database insertion (@jmmshn)