v0.1.1

Small bug fix release.

What's Changed

• Update conda availability by @marvinfriede in #170
• Support PyTorch 2.4.1 by @marvinfriede in #171
• Support Python 3.12 by @marvinfriede in #172
• Add example for challenging SCF convergence by @marvinfriede in #173
• Fix batched charges by @marvinfriede in #180

Full Changelog: v0.1.0...v0.1.1

v0.1.0

Windows and macOS support (without the libcint interface).

What's Changed

• Add citation by @marvinfriede in #160
• Improve code quality by @marvinfriede in #157
• Refactor integral code by @marvinfriede in #162
• Fix code scanning issues by @marvinfriede in #165
• Make libcint interface optional by @marvinfriede in #166
• Fix docs and consistency checks in calculator getters by @marvinfriede in #168

Full Changelog: v0.0.1...v0.1.0

v0.0.1

Initial release of dxtb.