Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
Can I study the effect of solvent dilution of my sample?
Siddheshwar Chopra
sidhusai@gmail.com
Dear Users,
I want to study the effect of solvent addition to some nanoclusters on their absorption and electronic properties. Is it possible in FIREFLY? If yes then could you please send me some details on how to go about it?
Do I need to optimize the ground state of my sample along with the solvent; if I want to study absorption?Kind Regards,
![[ Previous ]](/ceilidh-icons/ceil_prv.gif)
![[ Next ]](/ceilidh-icons/ceil_nxt.gif)
![[ Index ]](/ceilidh-icons/ceil_ind.gif)
Thu Jun 5 '14 9:13pm
![[ Reply ]](/ceilidh-icons/ceil_rep.gif)
![[ Edit ]](/ceilidh-icons/ceil_edt.gif)
![[ Delete ]](/ceilidh-icons/ceil_del.gif)
This message read 678 times