Quick question: Keyword to obtain higher roots for KRMCSCF

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Minori Abe

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Jan 25, 2025, 12:40:36 AMJan 25
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Dear Dirac experts,

Can you  please teach me how to optimize higher roots in KRMCSCF?
I am ataching the H2O output file wihch seems OK for the lowest state.
(We are currently try to run non linear molecules to connect CASSCF and CASPT2.)
Thank you very much in advance.

Minori Abe
Hiroshima university
H2O.krmcscf_microdefault.out
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