Open AccessComparative study of Minnesota functionals performance on ferroelectric BaTiO 3 PbTiO 3
Author(s) -
Maggie Kingsland,
Kelli Ann Lynch,
S. Lisenkov,
Xiao He,
I. Ponomareva
Publication year - 2020
Publication title -
physical review materials
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.439
H-Index - 42
eISSN - 2476-0455
pISSN - 2475-9953
DOI - 10.1103/physrevmaterials.4.073802
Subject(s) - ferroelectricity , hybrid functional , parametrization (atmospheric modeling) , materials science , density functional theory , algorithm , correlation , thermodynamics , computer science , physics , mathematics , dielectric , geometry , quantum mechanics , optoelectronics , radiative transfer
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