Subject: ab-initio calculation on conjugated Dienes

From: Pino Milano <[email-masked]>
Date: Mon, 26 Oct 1998 09:34:52 +0100

Dear Netters,
I would appreciate to receive some informations about ab-inito or DFT
calculations on dienes or dienes conjugated.  In particular on eta3
(allylic) and
eta1 (sigma) equilibria tipical of these system when they are bounded to
metals.

Thanks in advance
Pino
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Pino Milano
University of Salerno
ITALY
e-mail [email-masked]
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