Subject: transition metal redox

From: Paul Heelis <[email-masked]>
Date: Tue, 3 Oct 1995 05:00:30 -0400

Dear CCl's,
I am interested in using the SAM1 method and ZINDO to correlate
the redox properties of various Iron II and III complexes with computed
parameters such as HOMO energy, IP potential.
Has anyone come across similar work or would like to suggest the best approach.
Any useful replies will be summarised.

Paul Heelis
North East Wales Institute, UK
[email-masked]