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A unified moment tensor potential for silicon, oxygen, and silica
Karim Zongo
, Hao Sun
,
Claudiane Ouellet-Plamondon
, Laurent Karim Béland
École de technologie supérieure
Construction Engineering Department
LGEPE – Water Engineering and Environmental Processes Laboratory
École de technologie supérieure
Queen's University Kingston
Research output
:
Contribution to journal
›
Journal Article
›
peer-review
13
Citations (Scopus)
Overview
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Datasets
(1)
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Dive into the research topics of 'A unified moment tensor potential for silicon, oxygen, and silica'. Together they form a unique fingerprint.
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Material Science
Ab Initio Method
100%
Atomic Structure
100%
Crystal Structure
100%
Density
100%
Oxide Compound
100%
Point Defect
100%
Silicon
100%
Silicon Dioxide
100%
Chemistry
Calculation Method
50%
Crystal Defect
50%
Crystal Point Defect
50%
Crystal Structure
50%
Density Functional Theory
100%
Dioxygen
100%
Disordered Structure
50%
Interatomic Potential
50%
Oxide
50%
Silicon
100%
Silicon Dioxide
100%
Keyphrases
Ab Initio Methods
25%
Atomic Structure
25%
Charge Transfer
25%
Comprehensive Dataset
25%
CRISTAL
25%
Defected Ground Structure
25%
Density Functional Calculations
25%
Disordered Structure
25%
Dynamic Features
25%
Extended Defects
25%
Interatomic Interaction
25%
Machine Learning Potential
25%
Moment Tensor Potential
100%
Oxides
25%
Si-SiO2
50%
Silica
100%
Static Features
25%
Systems-based
25%
Technological Importance
25%
Theoretical Research
25%