COSMO solvation model: Difference between revisions

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:<math>q = f(\varepsilon) q^*.</math>
 
The factor ''&fnof;''(''&epsilon;'') is approximately<ref>{{cite journal |author=Q-Chem |title=11.2 Chemical Solvent Models |url=http://www.q-chem.com/qchem-website/manual/qchem43_manual/sect-solvent.html |journal=Q-Chem 4.3 User’s Manual ||publisher=Q-Chem.inc}}</ref>
The factor ''&fnof;''(''&epsilon;'') is approximately
 
:<math>f(\varepsilon)=\frac{\varepsilon-1}{\varepsilon+x},</math>