Monolayers of amphiphilic molecules at the air-water interface exhibit
a phase transition from a state in which the molecules are normal to
the interface to one in which they are tilted. Molecular-dynamics simu
lations have been used to investigate the relation between chain confo
rmation and tilt transition, and the effect of temperature thereupon.
Results show that a decrease in temperature induces an increase in til
t angle and conformational order. Monolayers at 275 and 300 K undergo
a clear tilt transition at approximately 0.20 mm2/molecule. At high de
nsity, the tilt behaviour at equilibrium and during relaxation is coup
led to the formation of gauche defects.