Thermodynamic properties


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Posted by Balazs Hajgato on May 13, 2002 at 19:14:48:

DeltaG = 29.36 kcal/mol
ZPVE = 31.65 kcal/mol
TotDeltaU = 33.58 kcal/mol
TotDeltaU - ZPVE = 1.94 kcal/mol
DeltaS = 15.4837 eu/mol <- what kind of unit?
U(T&R) = 1.6275 kcal/mol
Tot(temp)= 3.5652 kcal/mol

I would like to know the meaning of the above abbreviations. ex. DeltaG is delta for what? for the total energy? And so on with the oter abbreviations.

thanks in advance on.
e-mail hajgato (at) iris.inc.bme.hu


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