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PTEROSOR
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QuAcK
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UHF is working
2019-03-19 11:21:34 +01:00
# nAt nEla nElb nCore nRyd
cleanup excitation_energy
2019-04-02 09:59:30 +02:00
1 16 16 0 0
inital commit for quack
2019-02-07 22:49:12 +01:00
# Znuc x y z
cleanup excitation_energy
2019-04-02 09:59:30 +02:00
X 0.0 0.0 0.0
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