Structure of a Liquid Vapor Interface

Cover Structure of a Liquid Vapor Interface
Structure of a Liquid Vapor Interface
Malvin H Kalos
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A more detailed analysis using longer simulations and larger surface area is now being undertaken and will be reported in due course.
-24- 6. Conclusions The density profile fourd by Rao and Levesaue appears superficially to indicate a sn^ooth and uninteresting transition frorr liquid to vapor extending over a broad range of about five length units. Put we find as a result of the further analysis presented here that the interface has considerable structure. In particular, the transverse structu
...re factor does not interpolate sirioothly in the interfacial region. On the contrary, it exhibits a striking peak for small k in the inter- face. We interpret this as evidence of capillary waves in the interface whose leading terrr for srrall k gives rise to a struc- ture factor contribution S(z, z';k) a d'(2)p'(z'). In addition, we find that purely longitudinal correlations are consistent with a model in which the interface is taken to be planar, sharp, and fluctuating in location. Taken with the evidence provided by snapshots of atoms in the interface, we conclude that the delineation between liquid and vapor is rather abrupt — of the order of one atomic diameter for our parameters -- but that this boundary fluctuates markedly in position and time.

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