Z(N) model of grain-boundary wetting
- 1 April 1987
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 35 (10) , 5030-5035
- https://doi.org/10.1103/physrevb.35.5030
Abstract
Even though van der Waals forces should prevent the wetting of a grain boundary by a liquid at the melting temperature, experiment and simulations indicate an instability in grain-boundary structure in the vicinity of this temperature. We study the structure of analogous boundaries in a Z(N) model in which a region of solid with a given orientation is replaced by a spin in that orientation. Different interfacial behaviors are found for different regions of a model parameter which is related to N. For the value appropriate to grain boundaries, our model suggests that boundaries of a sufficiently large angle should be unstable, not to the intrusion of a layer of liquid, however, but to the intrusion of solid of intermediate orientation. Such an intrusion can occur below the melting temperature.Keywords
This publication has 14 references indexed in Scilit:
- Grain-Boundary Melting Transition in an Atomistic Simulation ModelPhysical Review Letters, 1986
- Thermodynamic Criteria for Grain-Boundary Melting: A Molecular-Dynamics StudyPhysical Review Letters, 1986
- Interfacial wetting in the q-state Potts modelJournal of Physics A: General Physics, 1986
- Critical effects at complete wettingPhysical Review B, 1985
- A molecular dynamics study of grain boundary phase equilibria: The case of the Σ = 13 boundarySurface Science, 1984
- Relations between intergranular diffusion and structure: A molecular dynamics studySurface Science, 1984
- High-angle grain-boundary premelting transition: A molecular-dynamics studyPhysical Review B, 1983
- Systematics of multilayer adsorption phenomena on attractive substratesPhysical Review B, 1982
- Heterophase dislocations — An approach towards interpreting high temperature grain boundary behaviorSurface Science, 1972
- Structure of grain boundariesProgress in Materials Science, 1972