5 research outputs found
Liquid Polymorphism and Double Criticality in a Lattice Gas Model
We analyze the possible phase diagrams of a simple model for an associating
liquid proposed previously. Our two-dimensional lattice model combines
oreintati onal ice-like interactions and \"{}Van der Waals\"{} interactions
which may be repulsive, and in this case represent a penalty for distortion of
hydrogen bonds in the presence of extra molecules. These interactions can be
interpreted in terms of two competing distances, but not necessarily soft-core.
We present mean -field calculations and an exhaustive simulation study for
different parameters which represent relative strength of the bonding
interaction to the energy penalty for its distortion. As this ratio decreases,
a smooth disappearance of the doubl e criticality occurs. Possible connections
to liquid-liquid transitions of molecul ar liquids are suggested