Ramp model: Difference between revisions

From SklogWiki
Jump to navigation Jump to search
m (→‎Repulsive Ramp Model: Slight tidy.)
Line 41: Line 41:
This solid phase presents re-entrant melting, i.e. this solid melts into the fluid phase as the pressure is increased.
This solid phase presents re-entrant melting, i.e. this solid melts into the fluid phase as the pressure is increased.


=== Repulsive Ramp Lattice Gas Model ===
==== Lattice gas version ====
Recently, similar  behaviour has been found in a three-dimensional Repulsive
Recently, similar  behaviour has been found in a three-dimensional Repulsive
Ramp [[lattice gas|Lattice Gas]] model  
Ramp [[lattice gas|Lattice Gas]] model  
Line 47: Line 47:
[http://dx.doi.org/10.1080/00268970902729269  Johan Skule Hoye,  Enrique Lomba, and  Noe Garcia Almarza, "One- and three-dimensional lattice models with two repulsive ranges: simple systems with complex phase behaviour",  Molecular Physics ''iFirst'' (2009)]
[http://dx.doi.org/10.1080/00268970902729269  Johan Skule Hoye,  Enrique Lomba, and  Noe Garcia Almarza, "One- and three-dimensional lattice models with two repulsive ranges: simple systems with complex phase behaviour",  Molecular Physics ''iFirst'' (2009)]
</ref>
</ref>
 
The system is defined on a simple cubic lattice. The interaction is that of a [[lattice hard spheres|lattice
The system is defined on a simple cubic lattice. The interaction is that of a [[lattice hard spheres|Lattice
hard sphere]] model with exclusion of nearest neighbours of occupied positions plus a repulsive interaction
hard sphere]] model with exclusion of nearest neighbors of occupied positions plus a repulsive interaction
with next-to-nearest neighbours.
with next-to-nearest neighbors.
 
The potential energy of the system is then given by:
The potential energy of the system is then given by:


:<math>
:<math>
U = \epsilon \sum_{[ij]} S_i S_j
U_{ij} = \epsilon \sum_{[ij]} S_i S_j
</math>
</math>


where <math> \epsilon > 0 </math> ; <math> [ij] </math> refers to all the pairs of sites that are
where <math> \epsilon > 0 </math> ; <math> [ij] </math> refers to all the pairs of sites that are
second neighbors, and <math> S_k </math> indicates the occupation of site <math> k </math>
second neighbors, and <math> S_k </math> indicates the occupation of site <math> k </math>
(0 indicates empty site, 1 indicates occupied site).
(0 indicates an empty site, 1 indicates an occupied site).


==See also==
==See also==

Revision as of 12:52, 9 March 2009

The ramp model, proposed by Jagla [1] and sometimes known as the Jagla model, is described by:

where is the intermolecular pair potential, , and .

Graphically, one has:

where the red line represents an attractive implementation of the model, and the green line a repulsive implementation.

Critical points

For the particular case , the liquid-vapour critical point is located at [2]:

and the liquid-liquid critical point:

Repulsive Ramp Model

In the repulsive ramp case, where , neither liquid-vapor nor liquid-liquid stable equilibria occur [2]. However, for this model a low density crystalline phase has been found. This solid phase presents re-entrant melting, i.e. this solid melts into the fluid phase as the pressure is increased.

Lattice gas version

Recently, similar behaviour has been found in a three-dimensional Repulsive Ramp Lattice Gas model [3] The system is defined on a simple cubic lattice. The interaction is that of a lattice hard sphere model with exclusion of nearest neighbours of occupied positions plus a repulsive interaction with next-to-nearest neighbours. The potential energy of the system is then given by:

where  ; refers to all the pairs of sites that are second neighbors, and indicates the occupation of site (0 indicates an empty site, 1 indicates an occupied site).

See also

References

Related literature