I am currently trying to figure out how CLP-PIXEL works.Does anyone know how to create .den file from .gjf file in Gaussian 09?

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Anil Kumar G N

Dear Vijay,

Please use the following commands in the input .gjf file

density=current output=wfn

Somananda Sanyal

Dear Anil Kumar,

So, don't we have to put density=MP2 pop=esp in the G09 *.com file? I am a bit confused at this step actually.

Thanks!

Regards,

Somananda

Dear Sanyal

The correct input file of G09 to create .den file use the following input

#MP2/6-31G** guess=core nosym density=MP2 pop=esp cube=cards cube=frozencore

Regards

Anil