Research Project in Detail

*J. Am. Chem. Soc.* 2023, 145, 20, 11364–11374

Title
   Splitting of Hydrogen Atoms into Proton–Electron Pairs at BaO–Ru Interfaces for Promoting Ammonia Synthesis under Mild Conditions

Publication
   Published at Journal of the American Chemical Society, as a co-first author
   J. Am. Chem. Soc. 2023, 145, 20, 11364–11374

Laboratory, Co-worker and Advisor
   M-design Laboratory, Pf. Hyungjun Kim
   (Experimental co-worker: Yaejun Baik et al., Pf. Minkee Choi)

Duration
   Dec. 2021 – Apr. 2023

Introduction
   Investigate the separate storage of H⁺/e^– pairs at the BaO–Ru interface that promotes ammonia synthesis, using DFT calculation