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20162022
most citedEfficient, Interpretable Graph Neural Network Representation for Angle-dependent Properties and its Application to Optical Spectroscopy

5 citations · 10 across the 5 of their papers we have counts for

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Showing 2021 · cond-mat.mtrl-sciShow all

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cond-mat.mtrl-sci2021★ 1 cited

Quantifying Free-volume Topology in Atomistic Structures Through a Combination of Voxelization and Graph Theory

James Chapman, Nir Goldman

We introduce a new computational methodology for the identification and characterization of free volume within/around atomistic configurations. This scheme employs a three-stage wo…