WyCryst: Wyckoff inorganic crystal generator framework

WyCryst: Wyckoff inorganic crystal generator framework

Recent advancements in property-directed generative design of inorganic materials account for periodicity and global Euclidian symmetry through translations, rotations, and reflections; however, they do not account for symmetry constraints within allowed space groups. To address this, we introduce a...

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Bibliographic Details
Main Authors: Zhu, Ruiming, Nong, Wei, Yamazaki, Shuya, Hippalgaonkar, Kedar
Other Authors: School of Materials Science and Engineering
Format: Article
Language:English
Published: 2024
Subjects:
Engineering
Design
Models
Online Access:https://hdl.handle.net/10356/180690
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Institution: Nanyang Technological University
Language: English

Internet

https://hdl.handle.net/10356/180690

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