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Published on: October 20, 2023
Data for quantum phonon transport in strained carbon atomic chains bridging graphene and graphene nanoribbon
Hu Sung Kim1, Tae Hyung Kim1, Yong-Hoon Kim1
1School of Electrical Engineering and Graduate School of EEWS, Korea Advanced Institute of Science and Technology (KAIST), 291 Daehak-ro, Yuseong-gu, Daejeon 305-701, Republic of Korea.
Abstract:
The data presented in this article are related to "Odd-even phonon transport effects in strained carbon atomic chains bridging graphene nanoribbon electrodes" (Kim et al., 2019). To provide the information that can be utilized in reproducing our results, we provide the fully optimized graphene nanoribbon (GNR)-carbon chain (CC)-GNR junction atomic configurations at different strain values, the computational setting for quantum phonon transport calculations, and several computational data that were not included in the main manuscript. Data on graphene-CC-graphene junctions are additionally presented.
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