논문
학회 94곳에서 발표 165건
Unraveling the Role of Re Doping in Metastable Hexagonal Ir Catalysts for Enhanced OER Performance—A DFT Study
Selective Hydrogen Peroxide Production via Structural Variations in Molybdenum Phosphide Catalysts—A Density Functional Theory Study
Exploring HER Activity Descriptors for Early Transition Metals—Insights from DFT Analysis of Ir3M (M=V, Ta, Nb) Electrocatalysts
Computational Insights into the Improved Structural Stability and Electrochemical Behavior of NaVO Cathodes for Aqueous Zinc-Ion Batteries
Effect of Open Metal Sites on Methane Adsorption in Metal-Organic Framework HKUST-1
Selective Hydrogen Peroxide Production via Structural Variations in Molybdenum Phosphide Catalysts: a Density Functional Theory Study
Effect of Rh single atom introduction on TiO2/CNF catalyst for alkaline water electrolysis
Unraveling the Enhanced Catalytic Performance of Ag-Doped Zn3(PO4)2 for CO2RR
Incorporation of Amorphous Overlayer on Metal Oxide for Efficient Photoelectrochemical Organic Waste Oxidation
Computational Materials Design of High-Performance Electrocatalysts for Sustainable Water Electrolysis Technology
Effect of Open Metal Sites on Methane Adsorption in Metal-Organic Framework HKUST-1
Exploring the origin of metastable hexagonal Ir catalyst with Re incorporation as a superior OER catalysts: A DFT study
Recycling Battery Waste LiCoO2 as an Electrocatalyst for Water Electrolysis
A Computational Study of the Enhanced Structural Stability and Electrochemical Performance of NaVO Cathodes in AZIBs
소재 온톨로지 기반 연구데이터 통합을 위한 소재 생태계 플랫폼 구축
소재 HUB 구축 사업의 데이터 통합을 위한 온톨로지 기반 생태계 플랫폼 구축
Computational Design of Water Electrolysis Electrocatalysts through Insight into Metal-Oxide Synergistic Interactions
Exploring Synergistic Interactions in Metal-Oxide Electrocatalysts for Water Electrolysis
Developing High-Performance Electrocatalysts: From High-Throughput Density Functional Theory Calculations to Experimental Verifications
Computational Design and Experimental Verification of New Electrocatalysts for Oxygen Reduction Reaction
Ir 저감형 PEM 수전해 고효율 고내구 촉매 전극 개발
Enhanced OER performance of Ir-based catalysts with Re doping: A DFT Study
Optimal Low-Iridium Electrocatalysts for Acidic Water Electrolysis: A Computational Design Approach
Development of a remarkable ORR catalyst using 2D materials with metal decoration: From theoretical catalyst design to experimental verification
In-situ Growth of a Ni-Fe Layered Double Hydroxide for Exceptional Operational Stability in a Water Electrolysis System
Computational Design of High Performance Electrocatalysts with Minimal Ir Content for Acidic Water Electrolysis
Computational Design of High Performance Electrocatalysts through Understanding of Synergistic Metal-Oxide Interactions
Unravelling the Origin of the Superior OER Performance of Calcium Copper Titanate (CaCu3Ti4O12) with Low-Iridium Dopants
Computational Design of High Performance Electrocatalysts with Metal-Oxide Synergistic Effect for Water Electrolysis
Perovskite-structured calcium copper titanate with low Ir content as an efficient electrocatalyst for oxygen evolution reaction
Characterization by DFT Calculations to Achieve High Selectivity of the Mars-Van Krevelen Mechanism in Nitrogen Reduction Reactions of Nitride Catalysts
Unraveling the role of Ir doping for superior OER electrocatalysts of CaCu3Ti4O12: A theoretical study
A Computational Study of the Properties of Ternary Nitride Catalysts inducing the MvK mechanism in Nitrogen Reduction Reactions
Design of an electrocatalyst for superior oxygen reduction reaction using metal-decorated 2D materials: a combined theoretical and experimental study
Characterization of Nitride Catalysts by DFT Calculations to Achieve High Selectivity of the MvK Mechanism in Nitrogen Reduction Reactions
Effect of nitrogen ligand type on 3d orbital level rearrangement of cobalt single atom catalysts
Design of High-performance Electrocatalysts for Green Hydrogen Production and Uses
Computational design of single-atom supported 2D materials for a superior oxygen reduction reaction catalyst
Spin state control of CoS2 by substituting anions for nitrogen reduction reaction
Enhancing the Photoelectrochemical Water Oxidation via Strained Homogeneous Interlayer