[gmx-users] Excess Heat of mixing

AMNINDER SINGH virkblitz at yahoo.com
Thu Jul 3 06:17:54 CEST 2014

Dear People,

I am trying to calculate heat of mixing of two solvents using inter molecular energies.

I have calculated heat of vaporization of both solvents in pure form and results are in agreement with  experimental and theoretical data.

But, I can't find a right equation to calculate heat of mixing.

Any help will be highly appreciated.


Kind regards.
Amninder Virk

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