Ricc2
Topics
[1] COSMO-ADC(2) excited gradients
[2] Printing configurations with smaller weights for excited states in ricc2 calc.
[3] Calculating only particular higher-lying excited states (S3-S6) with ADC2/CC2
[4] Getting MP2 or CC2 gradients for S0 in the gradient file without jobex script
[5] spin orbit coupling between excited singlet and triplet states
[6] frequency mismatch in cc density module
[7] Queerness/Issue observed with RI-basis set
[8] Geometry optimization of the lowest triplet state
[9] CC2 with COSMO for excited states
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