Orthorhombic phase of crystalline polyethylene: A Monte Carlo study

Martonak, R.; Paul, W.; Binder, K.
June 1997
Journal of Chemical Physics;6/1/1997, Vol. 106 Issue 21, p8918
Academic Journal
Presents a classical Monte Carlo simulation of the orthorhombic phase of crystalline polyethylene. Use of an explicit atom force field with unconstrained bond lengths and angles; Development of an algorithm which employs global moves consisting of displacements.


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