[gmx-users] Excess Heat of mixing

[Amninder]

I have tried everything...even most the results in literature are not consistent to each other...actually I became more confused after reading literature..I am hoping that some one must've calculated for water-alcohol mixtures and explained in detail

Sent from my iPhone

On 03-Jul-2014, at 8:42 PM, Justin Lemkul <jalemkul at vt.edu> wrote:

> 
> 
> On 7/3/14, 12:17 AM, AMNINDER SINGH wrote:
>> 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.
> 
> Have you tried Google?
> 
> -Justin
> 
> -- 
> ==================================================
> 
> Justin A. Lemkul, Ph.D.
> Ruth L. Kirschstein NRSA Postdoctoral Fellow
> 
> Department of Pharmaceutical Sciences
> School of Pharmacy
> Health Sciences Facility II, Room 601
> University of Maryland, Baltimore
> 20 Penn St.
> Baltimore, MD 21201
> 
> jalemkul at outerbanks.umaryland.edu | (410) 706-7441
> http://mackerell.umaryland.edu/~jalemkul
> 
> ==================================================