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Adrienn Ruzsinszky
Researcher at Temple University
Publications - 140
Citations - 19816
Adrienn Ruzsinszky is an academic researcher from Temple University. The author has contributed to research in topics: Density functional theory & Hybrid functional. The author has an hindex of 42, co-authored 132 publications receiving 15893 citations. Previous affiliations of Adrienn Ruzsinszky include Tulane University & Budapest University of Technology and Economics.
Papers
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Journal ArticleDOI
Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces
John P. Perdew,Adrienn Ruzsinszky,Gábor I. Csonka,Oleg A. Vydrov,Gustavo E. Scuseria,Lucian A. Constantin,Xiaolan Zhou,Kieron Burke +7 more
TL;DR: A revised Perdew-Burke-Ernzerhof generalized gradient approximation is introduced that improves equilibrium properties of densely packed solids and their surfaces.
Journal ArticleDOI
Strongly Constrained and Appropriately Normed Semilocal Density Functional.
TL;DR: In this article, the first meta-generalized-gradient approximation (meta-GGA) that is fully constrained, obeying all 17 known exact constraints that a meta GGA can, was proposed.
Posted Content
Strongly Constrained and Appropriately Normed Semilocal Density Functional
TL;DR: In this paper, the first meta-generalized gradient approximation (GGA) that is fully constrained, obeying all 17 known exact constraints that a meta-GGA can, was proposed.
Journal ArticleDOI
Prescription for the design and selection of density functional approximations: more constraint satisfaction with fewer fits.
John P. Perdew,Adrienn Ruzsinszky,Jianmin Tao,Viktor N. Staroverov,Gustavo E. Scuseria,Gábor I. Csonka +5 more
TL;DR: It is argued for the theoretical and practical importance of recovering the correct uniform density limit, which many semiempirical functionals fail to do.
Journal ArticleDOI
Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional
Jianwei Sun,Richard C. Remsing,Yubo Zhang,Zhaoru Sun,Adrienn Ruzsinszky,Haowei Peng,Zeng-hui Yang,Arpita Paul,Umesh V. Waghmare,Xifan Wu,Michael L. Klein,John P. Perdew +11 more
TL;DR: It is shown that the recently developed non-empirical strongly constrained and appropriately normed SCAN meta-generalized gradient approximation (meta-GGA) within the density functional theory framework predicts accurate geometries and energies of diversely bonded molecules and materials.