Hierarchical bounding structures for efficient virial computations:
Towards a realistic molecular description of cholesterics

Hierarchical bounding structures for efficient virial computations: Towards a realistic molecular description of cholesterics

We detail the application of bounding volume hierarchies to accelerate second-virial evaluations for arbitrary complex particles interacting through hard and soft finite-range potentials. This procedure, based on the construction of neighbour lists through the combined use of recursive atom-decompos...

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Bibliografiske detaljer
Main Authors:	Tortora, M, Doye, J
Format:	Journal article
Udgivet:	AIP Publishing 2017

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