A first-principles study on the adsorption of small molecules on antimonene : oxidation tendency and stability

• Main Authors: Kistanov, Andrey A., Cai, Yongqing, Kripalani, Devesh Raju, Zhou, Kun, Dmitriev, Sergey V., Zhang, Yong-Wei
• Other Authors: School of Mechanical and Aerospace Engineering
• Format: Article
• Language: English
• Published: 2020
• Subjects: Engineering::Mechanical engineering; Adsorption; Antimonene
• Online Access: https://hdl.handle.net/10356/140638
• Institution: Nanyang Technological University

Antimonene, a new group-VA 2D semiconducting material beyond phosphorene, has been recently synthesized through various approaches and shown to exhibit good structural integrity under ambient conditions and various interesting properties. In this study, we performed systematical first-principles inv...