CCL:G: magentic susceptibility from gaussian program
- From: "Mahalakshmi. S." <mlakshmis||gmail.com>
- Subject: CCL:G: magentic susceptibility from gaussian program
- Date: Wed, 20 Jun 2007 19:34:31 +0530
Dear CCL members,
In the output of g03 program for calculating the magnetic
susceptibility, its given as cgs-ppm. Magnetic anisotropy is obtained
by subtracting magnetic susceptibility_parallel and magnetic
susceptibility_perpendicular. How do you convert the magnetic
anisotropy from cgs-ppm to m3/molecule ? I would like to thank in
advance the members who respond to this message.
Thanks,
Lakshmi