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Triple-Bond Vibrations: Emerging Applications in Energy and Biological Sciences.

Liang ZhouRan-Ran FengWenkai ZhangFeng Gai
Published in: The journal of physical chemistry letters (2023)
Triple bonds, such as that formed between two carbon atoms (i.e., C≡C) or that formed between one carbon atom and one nitrogen atom (i.e., C≡N), afford unique chemical bonding and hence vibrational characteristics. As such, they are not only frequently used to construct molecules with tailored chemical and/or physical properties but also employed as vibrational probes to provide site-specific chemical and/or physical information at the molecular level. Herein, we offer our perspective on the emerging applications of various triple-bond vibrations in energy and biological sciences with a focus on C≡C and C≡N triple bonds.
Keyphrases
  • physical activity
  • mental health
  • molecular dynamics
  • density functional theory
  • molecular dynamics simulations
  • single molecule
  • transition metal
  • electron transfer
  • healthcare