Controlling HER activity and stability of $γ$- and 6,6,12-Graphyne through engineered B-N doping: DFT and Reactive MD simulations
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arXiv
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| Main Authors: | Quispe, Juan Gomez, Medina, Matheus, Mishra, Subhendu, Galvao, Douglas S, Singh, Abhishek, Autreto, Pedro Alves da Silva |
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| Format: | Preprint |
| Published: |
2026
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| Online Access: | |
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