Open AccessSimilarity Clustering for Representative Sets of Inorganic Solids for Density Functional Testing
Author(s) -
Péter Kovács,
Fabien Tran,
Allan Hanbury,
Georg K. H. Madsen
Publication year - 2021
Publication title -
journal of chemical theory and computation
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 2.001
H-Index - 185
eISSN - 1549-9626
pISSN - 1549-9618
DOI - 10.1021/acs.jctc.1c00536
Subject(s) - cluster analysis , benchmarking , set (abstract data type) , computer science , data mining , similarity (geometry) , process (computing) , data set , space (punctuation) , algorithm , artificial intelligence , marketing , business , image (mathematics) , programming language , operating system