xtb-python version 22.1

What's Changed

• Bump xtb submodule to 6.4.0 version by @awvwgk in #43
• Use np.ascontiguousarray rather than np.array by @awvwgk in #50
• Fix unknown option error in meson >= 0.60.0 by @bwvdg in #66
• Update to xtb 6.4.1 by @awvwgk in #69
• Add support for verbosity keyword by @jthorton in #74
• Update version tags by @TyBalduf in #77
• Fix mypy of setVerbosity by @TyBalduf in #79
• Fixed a typo in the Readme.md by @sNeves20 in #84
• Update meson_options to match xtb by @TyBalduf in #81
• Update installation setup to a PEP517 build backend by @awvwgk in #95
• Add CodeQL workflow for GitHub code scanning by @lgtm-com in #91
• Add workflow for building wheels by @awvwgk in #96

New Contributors

• @bwvdg made their first contribution in #66
• @jthorton made their first contribution in #74
• @TyBalduf made their first contribution in #77
• @sNeves20 made their first contribution in #84

Full Changelog: v20.2...v22.1

xtb-python version 20.2

• OSX support
• support external charge potentials
• allow usage of IPEA-xTB parametrisation (requires XTBPATH set correctly)
• ASE support: fit calculator setup in tests
• QCSchema support: preserve fields present in extra

xtb-python version 20.1

Initial version of xtb-python.

• provides basic access to most features of the xtb API v1.0.0
• integration with ASE available
• support for QCSchema input