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

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cond-mat.mtrl-sci2022★ 1 cited

Pair distribution function analysis driven by atomistic simulations: Application to microwave radiation synthesized TiO and ZrO

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…