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srdft_tutorial
92f912ca
·
Apply 1 suggestion(s) to 1 file(s)
·
Jul 28, 2020
master
default
protected
7bc73dfc
·
Extract molecular gradients from LSDalton output
·
Jul 27, 2020
Illustrative_Calculations
c510cd85
·
Add CASsrDFT illustrative calculation
·
Jul 08, 2020
symmetry-bug
380c11d6
·
Merge branch 'master' of
https://gitlab.com/DaltonProject/daltonproject
into symmetry-bug
·
Jun 25, 2020
Simen/augment_PyLSDalton_integrals
1f9e625d
·
Update ep-example to include dipoles
·
Jun 09, 2020
pyframe-interface
9cf00134
·
Merge branch 'pyframe-interface' of gitlab.com:daltonproject/daltonproject into embedding
·
May 12, 2020
pydocstyle
24600d1b
·
Check docstring style in pre-commit hook
·
Mar 22, 2020
cube-files
58f753eb
·
Apply suggestion to daltonproject/gaussian_basis_function.py
·
Mar 19, 2020
lrmp2srmp2
dba5ff06
·
Merge branch 'cisrdft' of
https://gitlab.com/daltonproject/daltonproject
into lrmp2srmp2
·
Mar 09, 2020
integrate-pyframe
e0718836
·
Fixed failing tests
·
Jan 09, 2020