Abstract
The fluid-cubic plastic crystal coexistence curve for the hard dumbbell model is determined from Monte Carlo simulations. A transition to a stable plastic crystal phase is found for reduced bond lengths L/σ<0.4. A metastable plastic crystal is observed at slightly longer bond lengths. Orientational correlations in both the fully ordered and plastic crystal phase are examined. This is the first calculation of the complete coexistence curve between two phases as a function of particle anisotropy. This information permits detailed comparison with several recent density functional theory predictions for the same transition.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.