• New pyamtgen.io.vasp.VaspDir class for easy navigation of VASP directories as pymatgen objects.
• Fix gaussian input parser (@sio-salt)
• Fix: preserve site properties over cell transform (@Lattay)
• Make Incar keys case insensitive, fix init Incar from dict val processing for str/float/int (@DanielYang59)
• Fix: Preserve PBC info in AseAtomsAdaptor (@jsukpark)
• Migrate ext.COD from mysql to REST API (@DanielYang59)
• Fix: Parsing bugs in io.pwscf.PWInput (@jsukpark)
• Fix arg passing in inverse property of SymmOp (@DanielYang59)
• Add support for use_structure_charge keyword in FHI-aims input generator (@ansobolev)
• Fix: savefig in pmg.cli.plot (@DanielYang59)
• Fix: Volumetric data and XDATCAR parsing for monatomic structures (@esoteric-ephemera)
• Support to aims format from Structure instance (@ansobolev)
• Fix: Bugfix for Ion CO2(aq) reduced formula (@rkingsbury)
• Replace deprecated ExpCellFilter with FrechetCellFilter (@ab5424)