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Keyphrases
First-principles Calculations
100%
Adsorption
100%
Cu Surface
100%
Capping Molecule
100%
Alkylamine
100%
Cu(111)
80%
Capping Agent
60%
Cu-Cu
20%
Binding Energy
20%
Surface Coverage
20%
Nanocrystals
20%
Van Der Waals Interaction
20%
Shape Selectivity
20%
Thermodynamic Calculation
20%
Stronger Binding
20%
Dispersion-corrected Density Functional Theory (DFT-D)
20%
Shape-based
20%
Ethylenediamine
20%
Wulff Shape
20%
Synthesis Conditions
20%
Molecular Packing
20%
Nanocrystal Formation
20%
Packing Constraint
20%
Ab Initio Thermodynamics
20%
Linear Molecule
20%
Solution Environment
20%
Cyclic Compounds
20%
Branched Molecules
20%
Geometric Matching
20%
Chemistry
First Principle
100%
Nanocrystalline Material
100%
Alkylamine
100%
Binding Energy
50%
Density Functional Theory
50%
Van Der Waals Force
50%
Ethylenediamine
50%
Nanowire
50%
Chemical Bond
50%
Material Science
Density
100%
Surface (Surface Science)
100%
Nanowire
50%
Chemical Bonding
50%
Pharmacology, Toxicology and Pharmaceutical Science
Aliphatic Amine
100%
Molecular Wire
50%
Chemical Bonding
50%
Ethylenediamine
50%
Van Der Waals Force
50%