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A flexible and scalable scheme for mixing computed formation energies from different levels of theory
Ryan S. Kingsbury
,
Andrew S. Rosen
, Ayush S. Gupta
, Jason M. Munro
, Shyue Ping Ong
, Anubhav Jain
, Shyam Dwaraknath
, Matthew K. Horton
, Kristin A. Persson
Research output
:
Contribution to journal
›
Article
›
peer-review
36
Scopus citations
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Keyphrases
Formation Energy
100%
Generalized Gradient Approximation
100%
Approximate Calculation
71%
Density Functional Theory
28%
Coverage Metrics
28%
Solid Phase
14%
Aqueous Phase
14%
High-throughput
14%
High Coverage
14%
Phase Stability
14%
Chemical System
14%
Computational Resources
14%
Accurate Method
14%
Low Coverage
14%
Degree of Approximation
14%
Large Database
14%
Stability Prediction
14%
Projected Database
14%
Materials Project
14%
High-throughput Calculations
14%
Throughput Density
14%
Computational Materials Discovery
14%
Computer Science
Generalized Gradient Approximation
100%
High Throughput
28%
Density Functional Theory
28%
Computational Resource
14%
Entire Database
14%
Material Science
Density
100%