Keyphrases
Absorption Studies
100%
Spatial Configuration
100%
X-ray Absorption
100%
Complex Metal Hydrides
100%
First-principles DFT Calculations
100%
Ti Species
100%
LiBH4
100%
MD Calculation
100%
Ni Species
100%
NaAlH4
75%
TiAl3
75%
Ti K-edge
50%
Structural Properties
25%
Hydrogen Storage Materials
25%
Crystal Lattice
25%
Local Structure
25%
Density Functional Calculations
25%
Valence
25%
Single Electron
25%
Reaction Rate
25%
Chemical Reactivity
25%
Extended X-ray Absorption Fine Structure (EXAFS)
25%
K-edge
25%
X-ray Absorption Near Edge Structure (XANES)
25%
Coordination number
25%
Edge Evaluation
25%
Debye-Waller Factor
25%
Surface Diffusion
25%
Interatomic Distance
25%
Multiple Scattering
25%
Hydrogenated
25%
Hydrogen Cycling
25%
K-edge XANES
25%
Cluster Expansion
25%
Structural-phase State
25%
TiCl3
25%
Ni Atom
25%
TiNi
25%
First-principles Molecular Dynamics Simulations
25%
Scattering Calculation
25%
TiB2
25%
Ni3B
25%
NiCl2
25%
Property Stability
25%
Hydrogen Loading
25%
Phase Stability
25%
Decomposition Reaction
25%
Ni Doping
25%
Engineering
Computer Simulation
100%
Monolayer
100%
Hydrogen Storage
100%
Structural Property
100%
Final Product
100%
Ray Absorption
100%
Local Structure
100%
Single Electron
100%
Spatial Configuration
100%
Structural Model
100%
Phase Stability
100%
Hydrogen Loading
100%
Physics
First-Principles
100%
X Ray Absorption
100%
X-Ray Absorption near Edge Structure
100%
Density Functional Theory
100%
Metal Hydride
100%
Crystal Structure
50%
Molecular Dynamics
50%
Hydrogen Storage
50%
Surface Diffusion
50%
Material Science
Amorphous Material
100%
Metal Hydride
100%
X-Ray Absorption near Edge Structure
66%
Crystal Structure
33%
Density
33%
Monolayers
33%
Hydrogen Storage Material
33%
Structural Property
33%
Extended X-Ray Absorption Fine Structure
33%
Surface Diffusion
33%
Chemical Decomposition
33%
Chemical Engineering
Surface Diffusion
100%
Metal Complex
100%
Pharmacology, Toxicology and Pharmaceutical Science
X-Ray Absorption
100%
Metal Complex
100%