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Niri Forum:Admin, Forum:Mod, NWChemDeveloper, bureaucrat, sysop
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Forum Regular
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| 5:07:26 PM PST - Wed, Jan 4th 2012 |
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Hi,
It's not a silly question at all. Those are not 3 transitions from 215 but the dominant
components of the transition vectors X and Y. Take a look at reviews by Casida on LR-TDDFT.
Let me know if you need further clarification.
Best regards,
-Niri
niri.govind@pnnl.gov
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