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adc-connect / adcc

adcc: Seamlessly connect your program to ADC
https://adc-connect.org
GNU General Public License v3.0
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Better automatic selection of frozen-core and frozen-virtual #108

Open mfherbst opened 3 years ago

mfherbst commented 3 years ago

Ideas are to use orbital energies for FC or HOMO-LUMO gap for FV.