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Allow more flexible TeraChem input #58

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hokru opened this issue Mar 30, 2020 · 0 comments
Open

Allow more flexible TeraChem input #58

hokru opened this issue Mar 30, 2020 · 0 comments
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hokru commented Mar 30, 2020

Currently only the basis set can change. Access to the dftd flag is needed for HF-3c computations.
More flexibility in general is desirable.
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