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PorosityPlus

CSIRO RDS Repository

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Title PorosityPlus
 
Creator George Opletal
 
Subject Simulation and Modelling
 
Description The PorosityPlus code can be used to calculate the surface area, volume and pore size distribution (PSD) of particle networks. These particles can be multiscale ranging from atoms, to nanoparticles to grains with the assumption that they can be modelled by spheres. It works on multi-frame xyz movies with up to 10 particle types defined by different particle type pair cutoff distances. Applied to gas adsorption studies, these particles can model atoms and the Monte Carlo routine uses a spherical probe useful for simulating pore accessibility of gases like helium and argon.
 
Publisher CSIRO
 
Contributor Amanda Barnard
 
Date 2018-09-04
 
Type
 
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Identifier csiro:34838
 
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