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Release 0.1.7
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fishjojo committed Jul 27, 2024
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16 changes: 16 additions & 0 deletions CHANGELOG.md
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# Change log

## pyscfad 0.1.7 (July 26, 2024)

* Changes
* Drop support to Python 3.8.
* Add `pytree.PytreeNode`.
* Adapt class definition using `PytreeNode`.
* Add `util.to_pyscf`.
* Update `gto.mole._moleintor_jvp` for shell slicing.
* Add `scipy.linalg.eigh` JAX primitive for CPU.
* Improve `lo.orth.lowdin` gradient stability.

* Bug fixes
* Fix example `dft/01-DFT+U.py`.
* Fix `scf.addons.canonical_orth_`.
* Fix GMRES solver for scipy versions before 1.12.

## pyscfad 0.1.6 (June 27, 2024)
* Changes
* Update GMRES solver according to scipy updates.
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2 changes: 1 addition & 1 deletion pyscfad/version.py
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__version__ = "0.1.6"
__version__ = "0.1.7"
2 changes: 1 addition & 1 deletion pyscfadlib/pyscfadlib/version.py
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__version__ = '0.1.6'
__version__ = '0.1.7'

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