Density functional theory calculations - Globe Thesis

Keyword [Density functional theory calculations] Result: 81 - 96 \| Page: 5 of 5
81.	Investigating The Steering Effects Of Substrate On The Surface Self-Assembly And Reactions Of Halogenated Aromatic Via Synchrotron Radiation Photoelectron Spectroscopy And Scanning Tunneling Microscopy
82.	Study On Oxidation Mechanism Of Active Oxygen Species In Photocatalytic Hydrogen Peroxide Production
83.	Theoretical Study On The Catalytic Oxidation Of HCHO And CH₃OH Over Ceria-based Catalysts
84.	Theoretical Study On Carbon-Based Single/Double Atom Catalysts For The NH₃-SCR Reaction
85.	First-Principles Study Of Graphene-Based Dual-Atom Catalysts For Oxygen Reduction Reaction
86.	Preparation Of Ag₂S-Au Heterogeneous Nanocomposites For Electrocatalytic CO₂ Reduction
87.	Research On Preparation Of Carbon-based Catalysts By Solution Plasma System And Their Electrocatalytic Performance
88.	Insights Into N-coordinated Bimetallic Sites Synergy During NO Selective Catalytic Reduction By CO
89.	Density Functional Theory Calculations Of Ti-based MIXenes Materials For Detecting Breath Biomarkers Of Chronic Disease
90.	Design And Synthesis Of Nitrogen-containing Aromatic Fluorescent Probes And Their Selective Recognition Of Metal Cadmium Ions
91.	An Atomic-Scale Study On Sintering Behaviors Of Metal Nanocatalysts On Surfaces Of Two-Dimensional Carbon Materials Via In Situ Transmission Electron Microscopy
92.	Facet-dependent Adsorption Of Vanadate On Hematite Facets
93.	Theoretical Study Of Methane-to-Methanol Conversion Over Metal-Exchanged FER Zeolite Catalyst
94.	Construction Of Transition Metal Sulphide And Graphene Oxide Based Composites And Their Application In Electrocatalysis
95.	Theoretical Calculation Studies On Two-dimensional Carbon-based Single-atom Catalysts
96.	Construction And Biological Activity Study Of Triaryl-substituted Silicon Chiral Functional Molecule
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