From owner-chemistry@ccl.net Sat May 12 04:03:01 2007 From: "may abdelghani may01dz.**.yahoo.fr" To: CCL Subject: CCL: spin polarisation Message-Id: <-34250-070512035902-29009-VlJhEXrF7nvzjll+gSwWuA**server.ccl.net> X-Original-From: may abdelghani Content-Transfer-Encoding: 8bit Content-Type: multipart/alternative; boundary="0-501075204-1178956736=:41386" Date: Sat, 12 May 2007 09:58:56 +0200 (CEST) MIME-Version: 1.0 Sent to CCL by: may abdelghani [may01dz|-|yahoo.fr] --0-501075204-1178956736=:41386 Content-Type: text/plain; charset=iso-8859-1 Content-Transfer-Encoding: 8bit Dear CCL’ers, When I want to examine the oxidation effect on the geometrical elements (bond length for example) of a molecule (organometallic one), I face this problem; the spin polarisation effect. I ask, when this factor (triplet vs. singlet, for example) begin have a height effect on the structural properties of a molecule. thanks... --------------------------------- Ne gardez plus qu'une seule adresse mail ! Copiez vos mails vers Yahoo! Mail --0-501075204-1178956736=:41386 Content-Type: text/html; charset=iso-8859-1 Content-Transfer-Encoding: 8bit
Dear CCL’ers,
When I want to examine the oxidation effect on the geometrical elements (bond length for example) of a molecule (organometallic one), I face this problem; the spin polarisation effect. I ask, when this factor (triplet vs. singlet, for example) begin have a height effect on the structural properties of a molecule.   
thanks... 


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