Respected Sir,
I have to find the atomisation
energy of VO molecule by using BPW91 funtional and LANL2DZ basis set on vanadium
atoms and a D95V basis set on oxygen atom by using gaussian 09. Please help me
how shoud i give input for this job and procedure. I shall be highly
oblized.
With Regards
Navjot
Kaur
Research scholor
Panjab
University
Chandigarh