Subject: MM PARAMETERS

From: <[email-masked]>
Date: Wed, 21 Feb 1996 12:10:47 +0000 (WE)

Hello all,

	I am trying to model the interactions of intercalated molecules

	in lamellar phosphates of Ti. I am looking for molecular mechanics

        parameters (van der Waals parameters at least) for this compounds.  

        Does anybody know where I could obtain these parameters or

	a method to calculate them ?

		Thanks in advance,

		Miguel A. Salvado

        Miguel A. Salvado
        Dpto. Quimica Fisica y Analitica
        Universidad de Oviedo
	E-mail: [email-masked]