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votca / xtp

GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in complex molecular systems
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fixes to options refactor #723

Closed rubengerritsen closed 3 years ago

rubengerritsen commented 3 years ago

I will collect all minor things that might need changing with suggested changes in this PR.

JensWehner commented 3 years ago

Thanks I missed those things.