Help to calculate the absorption spectrum

[mohamed khuili]

Thank you very much, Mr. Matt
     you give me the starting point I want and I will try to get the 
results. I have a quick question if you will permit: what are the 
spectroscopy that I can model with CP2K easily?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20140710/eeb09726/attachment.htm>