Subject: Calcule of the thermodynamics properties of complexs

From: "Teodorico de Castro Ramalho" <[email-masked]>
Date: Fri, 14 Jul 2000 13:47:08 -2:00

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