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Polyhedral Template Matching algorithm for analysis of molecular dynamics simulation data

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polyhedral-template-matching

Polyhedral Template Matching algorithm for analysis of molecular dynamics simulation data

The method is now included in OVITO and ASAP.

OVITO PTM documentation: http://www.ovito.org/manual/particles.modifiers.polyhedral_template_matching.html

ASAP PTM documentation: http://wiki.fysik.dtu.dk/asap/Local%20crystalline%20order

If you use PTM in a publication, please reference:

Peter Mahler Larsen and Søren Schmidt and Jakob Schiøtz Robust structural identification via polyhedral template matching Modelling Simul. Mater. Sci. Eng. 24 (2016) 055007

Article available at: http://stacks.iop.org/0965-0393/24/i=5/a=055007

Preprint available at: http://arxiv.org/abs/1603.05143

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  • Python 4.1%
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