How to calculate the electron affinity (EA) of the atoms that form anions in case of Ce activated Ca2SiO4? Also, what will be the ionic radii of Ca with respect to this host?
if ur using gaussian software optimse ur complex and read the output file u will get the electron affinity of ur complex in case ur having trouble in reading the file send me the output file as an attachment i will send u its electron affinity
Thanks Ms Saba for the reply. but i am not aware of the technique to calculate the EA so i am not able to understand how the software will help to calculate it and what sort of while is needed for the same. It will be nice if you could please guide me.
the cif file that u hav send as an attachment i am unable to open that .
send me the molecules structure only i dont need its data as an word doc . u can send the details as a message in my research gate account if u find that appropriate. instead of an open mail.