Gm. Xiong et al., PHASE-DIAGRAM AND PHASE-TRANSITIONS OF THE ADSORBATE SYSTEM S RU(0001) - A MONTE-CARLO STUDY OF A LATTICE-GAS MODEL/, Zeitschrift fur Physik. B, Condensed matter, 104(3), 1997, pp. 529-534
We investigate the phase diagram and the critical properties of the ad
sorbate system sulphur/ruthenium(0001) in the coverage region 0 < Thet
a < 1/3 using Monte Carlo simulations of a lattice gas model on a tria
ngular lattice. From experiments it is known that for low coverages an
island phase appears in the phase diagram of this system at low tempe
ratures. To capture this feature we include in our lattice gas model a
weak third neighbour attraction in addition to the repulsive first an
d second neighbour forces. The phase diagram obtained from simulations
of this model is in very good agreement with the experimental phase d
iagram. The critical properties of the lattice gas model are found to
be compatible with the results of experiments on the system sulphur/ru
thenium(0001). Finer details of the phase diagram, e. g. the location
of tricritical points, which may be difficult to assess experimentally
will also be discussed.