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Stability of Hyperlithiated Borides
Kiet A. Nguyen
, G. Naga Srinivas
, Tracy P. Hamilton
,
Koop Lammertsma
University of Alabama at Birmingham
Vrije Universiteit Amsterdam
Research output
:
Contribution to journal
›
Article
›
peer-review
15
Citations (Scopus)
Overview
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Chemistry
DFT-B3LYP Calculation
100%
Boride
100%
Energetics
50%
Cohesive Energy
50%
Enthalpy
25%
Møller-Plesset Perturbation Theory
25%
Hartree-Fock Calculation
25%
Reaction Enthalpy
25%
k·p perturbation theory
25%
Elimination Reaction Enthalpy
25%
Keyphrases
Borides
100%
Cohesive Energy
100%
Elimination Reactions
50%
Thermodynamically Stable
50%
Multiconfigurational
50%
SCF Method
50%