v0.2.16

New Features

• Support cp2k v9.1 ~ 2023 for cp2k/output format by @ChiahsinChu in #466, @link89 in #533
• Customized data types
  • allow custom data types for deepmd format by @njzjz in #476, #481
  • add a public method to register new DataType in a plugin by @njzjz in #505
  • support -1 shape in DataType by @njzjz in #510
  • add a public API to register data types dynamically by @njzjz in #532
• new format DFTB+ by @ruio248 in #511

Bugfixes

• deepmd/hdf5: handle empty systems and files by @njzjz in #469
• keep atom types when using DP models by @njzjz in #471
• fix set_size in to_deepmd_npy_mixed func by @iProzd in #477
• fix: writing abacus stru. by @starinthesky72 in #478
• Use stable sorting algorithms by @njzjz in #487
• avoid modifying appended system by @njzjz in #483
• Fix: bug in reading abacus md files by @YuLiu98 in #496
• Fix issue #517 by @wanghan-iapcm in #520

Documentation

• docs: add badges to README by @njzjz in #490
• docs: add format docs by @njzjz in #516
• add extra lines for code blocks in docstring by @njzjz in #523
• Update system.py by @ZhouXY-PKU in #524

CI/CD

• fix RTD builds by @njzjz in #468
• pin pymatgen to 2023.7.11 by @njzjz in #501
• Revert "pin pymatgen to 2023.7.11" by @njzjz in #504
• Delete requirements.txt by @njzjz in #527

Contribution from bots is ignored.

New Contributors

• @ChiahsinChu made their first contribution in #466
• @starinthesky72 made their first contribution in #478
• @YuLiu98 made their first contribution in #496
• @ruio248 made their first contribution in #511
• @ZhouXY-PKU made their first contribution in #524
• @link89 made their first contribution in #533

Full Changelog: 0.2.15...0.2.16