Dear All,
I have a short question whether Cholesky Decomposition (CD) is implemented in Psi4 for EOM-CCSD calculations?
Many thanks!
Best regards,
Evgeniy
Dear All,
I have a short question whether Cholesky Decomposition (CD) is implemented in Psi4 for EOM-CCSD calculations?
Many thanks!
Best regards,
Evgeniy
@crawdad will be the authority here, but I strongly believe no. There’s CD with ground-state CCSD or CCSD(T) for closed shell through fnocc.
No, CD-EOM-CC is not yet available in PSI4.