,

First-principles design of electrolyte-tolerant Ni-based multimetallic catalysts for methane steam reforming

,

Design of unused biomass reforming catalyst by using conditional generative model

,

Computational design of durable and selective double atom catalysts toward the electrochemical NH3 production: role of carbon defects

,

DFT(Density functional theory) 기본 개념과 촉매 설계 Basic Concept of DFT and Catalyst Design

,

Density functional theory design of alkali metal resistant alloy catalysts for direct internal reforming of CH4 in molten carbonate electrolysis cell