B. R. Jayan

most citedPair distribution function analysis driven by atomistic simulations: Application to microwave radiation synthesized TiO

_{2}

and ZrO

_{2}

1 citations · 1 across the 2 of their papers we have counts for

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cond-mat.mtrl-sci2022

Pair distribution function analysis for oxide defect identification through feature extraction and supervised learning

Shuyan Zhang, Jie Gong, Sharon Chu +3

Feature extraction and a neural network model are applied to predict the defect types and concentrations in experimental TiO $_{2}$ samples. A dataset of TiO $_{2}$ structures with vacan…

cond-mat.mtrl-sci2022★ 1 cited

Pair distribution function analysis driven by atomistic simulations: Application to microwave radiation synthesized TiO $_{2}$ and ZrO $_{2}$

Shuyan Zhang, Jie Gong, Daniel Xiao +2

A workflow is presented for performing pair distribution function (PDF) analysis of defected materials using structures generated from atomistic simulations. A large collection of…

Pair distribution function analysis for oxide defect identification through feature extraction and supervised learning

Pair distribution function analysis driven by atomistic simulations: Application to microwave radiation synthesized TiO2​ and ZrO2​

Pair distribution function analysis driven by atomistic simulations: Application to microwave radiation synthesized TiO $_{2}$ and ZrO $_{2}$