Nanoarchitectonics and Theoretical Evaluation on Electronic Transport Mechanism of Spin-Filtering Devices Based on Bridging Molecules

Nanoarchitectonics and Theoretical Evaluation on Electronic Transport Mechanism of Spin-Filtering Devices Based on Bridging Molecules

By combining density functional theory with the non-equilibrium Green’s function method, we conducted a first-principles investigation of spin-dependent transport properties in a molecular device featuring a dynamic covalent chemical bridge connected to zigzag graphene nanoribbon electrodes. The eff...

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Bibliographic Details
Main Authors: Haiyan Wang, Shuaiqi Liu, Chao Wu, Fang Xie, Zhiqiang Fan, Xiaobo Li
Format: Article
Language:English
Published: MDPI AG 2025-05-01
Series:Nanomaterials
Subjects:
first principle calculation
graphene nanoribbon
spin transport properties
spin-filtering effect
spin-rectifying
Online Access:https://www.mdpi.com/2079-4991/15/10/759
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