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I'm using freud Steinhardt to calculate the disorder parameter as defined by Kawasaki and Onuki (2011) https://doi.org/10.1063/1.3656762. A direct implementation in freud would be nice.
Motivation and Context
The networks I am working with are experimental ones and hence have a degree of disorder of e.g. the node locations compared to a perfect crystal. Moreover there can be differences in the number of neighbors and bond and dihedral angles. The disorder parameter would provide a quantification for the variances of bond orientational order between neighbors.
The text was updated successfully, but these errors were encountered:
This order parameter seems to give good results for the systems in the paper, however I wonder if there is a simpler way to detect disorder. How is this more useful than using, say, $D = 1 - Q_6$ as a disorder parameter?
Description
I'm using freud Steinhardt to calculate the disorder parameter as defined by Kawasaki and Onuki (2011) https://doi.org/10.1063/1.3656762. A direct implementation in freud would be nice.
Motivation and Context
The networks I am working with are experimental ones and hence have a degree of disorder of e.g. the node locations compared to a perfect crystal. Moreover there can be differences in the number of neighbors and bond and dihedral angles. The disorder parameter would provide a quantification for the variances of bond orientational order between neighbors.
The text was updated successfully, but these errors were encountered: