Mayer f-function: Difference between revisions
		
		
		
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The '''Mayer ''f''-function''', or ''f-bond'' is defined as:  | The '''Mayer ''f''-function''', or ''f-bond'' is defined as:  | ||
:<math>f_{12}=f(  | :<math>f_{12}=f({\mathbf r}_{12})= \exp\left(-\frac{\Phi_{12}(r)}{k_BT}\right) -1 </math>    | ||
where  | where  | ||
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:[[Image:Mayer_f_function.png]]  | :[[Image:Mayer_f_function.png]]  | ||
==Hard sphere model==  | |||
For the [[hard sphere model]]  the Mayer ''f''-function becomes:  | |||
: <math>  | |||
f_{12}= \left\{ \begin{array}{lll}  | |||
-1 & ; & r_{12} \leq  \sigma ~~({\rm  overlap})\\  | |||
0      & ; & r_{12} > \sigma ~~({\rm  no~overlap})\end{array} \right.  | |||
</math>  | |||
where <math>\sigma</math> is the hard sphere diameter.  | |||
==References==  | ==References==  | ||
#[http://dx.doi.org/10.1063/1.1723631 Joseph E. Mayer "Contribution to Statistical Mechanics", Journal of Chemical Physics '''10''' pp. 629-643 (1942)]    | #[http://dx.doi.org/10.1063/1.1723631 Joseph E. Mayer "Contribution to Statistical Mechanics", Journal of Chemical Physics '''10''' pp. 629-643 (1942)]    | ||
[[Category: Statistical mechanics]]  | [[Category: Statistical mechanics]]  | ||
[[Category: Integral equations]]  | [[Category: Integral equations]]  | ||
Revision as of 11:29, 13 July 2007
The Mayer f-function, or f-bond is defined as:
where
- is the Boltzmann constant.
 - is the temperature.
 - is the intermolecular pair potential.
 
Diagrammatically the Mayer f-function is written as
Hard sphere model
For the hard sphere model the Mayer f-function becomes:
where is the hard sphere diameter.
