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From: "Teodorico de Castro Ramalho" <teo&$at$&epq.ime.eb.br>
Organization: IME
To: chemistry ":at:" ccl.net
Date: Fri, 14 Jul 2000 13:47:08 -2:00
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Subject: Calcule of the thermodynamics properties of complexs
Priority: normal
Message-ID: <1E284F2985 -x- at -x- epq.ime.eb.br>

Hi,

  I am carrying through calculation of thermodynamic properties of
complexes of zinc and cadmium, using the PC Spartan Pro that
calculates these properties from the vibracionais frequencias of the
complexes.

  It would like to know, if possible, which are the
computational methods of calculation for the thermodynamic properties
and in the coordination composite case which would be most
trustworthy. It would like if possible references. 

                                    Thanks


Teodorico C. Ramalho
Military Insitute of engineering 
Group of Spectroscopy