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Tags: fdmalone/pyscf

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v1.4.5

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PySCF-1.4.5 release

v1.5-alpha

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Added a eigenvalue filter in tduks to solve numerical stability issue

v1.4.4

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Pyscf-1.4.4 release

v1.4.3

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Symmetric grids in cubegen. For issue pyscf#154

v1.4.2

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Update memory estimation for pbc.df.fft_jk

v1.4.1

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Version 1.4.1

v1.4.0

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Update setup.py and install doc

v1.4-beta

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1.4 beta release

v1.3.5

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Bugfix in CISD t2+=t2.transpose(1,0,3,2)

v1.3.4

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Fix bug in mol.has_ecp function