Exploring hydrophobicity or hydrophilicity of borophene surface via reactive molecular dynamics simulation

• Published in: Scientific reports Vol. 14; no. 1; pp. 21436 - 12
• Main Authors: Foroutan, Masumeh, Sababkar, Mahnaz, Bavani, Borhan Mostafavi
• Format: Journal Article
• Language: English
• Published: London Nature Publishing Group UK 13.09.2024; Nature Publishing Group; Nature Portfolio
• Subjects: 639/638/440; 639/638/542; 639/638/563; Borophene; Contact angle; Humanities and Social Sciences; Hydrogen bonding; Hydrogen bonds; Hydrophobicity; Molecular dynamics; multidisciplinary; Reactive molecular dynamic simulation; Science; Science (multidisciplinary); Simulation; Wettability; Borophene; Wettability; Reactive molecular dynamic simulation

Borophene, a novel two-dimensional material unveiled in 1998, has garnered significant interest among researchers due to its distinct mechanical and electrical characteristics. Efforts to experimentally synthesize borophene continue to captivate researchers’ interest in recent years. Given the curre...