Subject: Crystal field programs

From: [email-masked]
Date: Mon, 07 Apr 2003 11:49:37 -0400 (EDT)

Hello all,

Is anyone aware of any programs capable of predicting the electronic
spectra of lanthanide ions?  Specifically, I am interested in inputing the
coordinates of the interacting ligands, in addition to crystal field
parameters.  Other suggestions are welcome and I will summarize if there
are any requests to do so.

Thank you in advance,

Sean Hughes
Centre for Research in Molecular Modeling (CERMM)
Dept. Chemistry and Biochemistry
Concordia University
1455 de Maisonneuve Blvd. West
Montreal, Quebec
Canada
H3G 1M8
Tel: (514)-848-4260
Fax: (514)-848-2868