Optical activity

Optical activity

Postby pipelion2000 » Sat Oct 18, 2014 2:05 pm

Dear NBO staff:

Would it be possible to adapt the coupled oscillator theory of Kuhn (or other theories like polarizability, single oscillator etc) to calculate optical activity (alpha D for example) in the context of NBO?

Posts: 4
Joined: Mon Oct 13, 2014 7:08 pm

Re: Optical activity

Postby ericg » Sun Oct 26, 2014 4:42 pm


There is interest in "through-bonds" effects in optical activity dispersion but we haven't pursued this interest for some time. This feature is under consideration for a future revision of NBO6.

Posts: 317
Joined: Sat Dec 29, 2012 9:31 am

Return to Feature Request

Who is online

Users browsing this forum: No registered users and 0 guests