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ifilot / pyqint

Python package for evaluating integrals of Gaussian type orbitals in electronic structure calculations
https://pyqint.imc-tue.nl
GNU General Public License v3.0
23 stars 8 forks source link

Removal of `build_integrals` #30

Open ifilot opened 9 months ago

ifilot commented 9 months ago

The function build_integrals is replaced by build_integrals_openmp. The docs should be updated accordingly.