Recent Changes - Search:

edit SideBar

Main /

EOM-CC Calculations For Ionized States

input and output for an EOM-CCSD calculation of IPs via the ESTATE_SYM keyword
input and output for an EOM-CCSD calculation of IPs via %excite*
input and output for an EOM-CC2 calculation of IPs
input and output for an EOM-CCSD(2) calculation of IPs
input and output for an EOM-CCSD calculation of IPs for an open-shell system
Edit - History - Print - Recent Changes - Search
Page last modified on January 07, 2023, at 02:35 PM
CFOUR is partially supported by the U.S. National Science Foundation.