Ac. Mitus et al., LOCATING LIQUID-SOLID TRANSITIONS IN COMPUTER-SIMULATIONS BASED ON LOCAL-STRUCTURE ANALYSIS, Journal of physics. Condensed matter, 5(45), 1993, pp. 8509-8522
The concept of local structure in fluids is applied to a complex model
fluid with classical translations in two dimensions and two internal
quantum states. We demonstrate the usefulness and efficiency of an ana
lysis based on local structure parameters that allows us to locate the
liquid-solid transition density from configurations generated by stan
dard constant-volume simulations. Our findings are in close agreement
with recent predictions from a density-functional treatment of this fr
eezing transition. In addition to these methodological aspects, open q
uestions concerning the conjectured existence of two triple points in
the two-dimensional fluid with internal quantum states can be settled.