Now showing items 112-114 of 55794

    • Computational Discovery of Codoped Single-Atom Catalysts for Methane-to-Methanol Conversion 

      Jia, Haojun; Duan, Chenru; Kevlishvili, Ilia; Nandy, Aditya; Liu, Mingjie; e.a. (American Chemical Society, 2024-02-13)
      The absence of a synthetic catalyst that can selectively oxidize methane to methanol motivates extensive study of single-site catalysts that possess a high degree of tunability in their coordination environments and share ...
    • Force-Activated Spin-Crossover in Fe2+ and Co2+ Transition Metal Mechanophores 

      Huang, Xiao; Kevlishvili, Ilia; Craig, Stephen L; Kulik, Heather J (American Chemical Society, 2024-12-23)
      Transition metal mechanophores exhibiting force-activated spin-crossover are attractive design targets, yet large-scale discovery of them has not been pursued due in large part to the time-consuming nature of trial-and-error ...
    • Fontimonas thermophila Alkane Monooxygenase (FtAlkB) Is an Alkyl Fluoride Dehalogenase 

      Hendricks, Lauren; Reinhardt, Clorice R; Green, Tierani; Kunczynski, Lily; Roberts, August Jaunzarins; e.a. (American Chemical Society, 2025-03-07)
      Purified alkane monooxygenase (AlkB) from Fontimonas thermophila (FtAlkB) catalyzes the defluorination of 1- fluorooctane, producing octanal, which is partially reduced under the reaction conditions to generate 1-octanol. ...