TURBOMOLE Modules > Ricc2

spin orbit coupling between excited singlet and triplet states

(1/1)

anpanda:
Hello,

Is it possible to compute spin-orbit coupling values between excited singlets and triplet states? We are interested in calculating these at ADC(2) level.

Thank you.

Aditya

christof.haettig:
Yes. This has been implemented since some years.

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