Kieron Burke

Centre National de la Recherche Scientifique — France

Physics and Astronomy · Physical Sciences

71h-index260.2kcitations400works2.02yr avg
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Research Topics

Advanced Chemical Physics Studies(233), Spectroscopy and Quantum Chemical Studies(95), Machine Learning in Materials Science(72), Quantum, superfluid, helium dynamics(39), Advanced Physical and Chemical Molecular Interactions(36)

Publications400 total

Generalized Gradient Approximation Made Thermal
arXiv (Cornell University)·2023· 15 citedOpen Access
DC-DFT for Open Shells: How to Deal with Spin Contamination
arXiv (Cornell University)·2023· 3 citedOpen Access
Exact Conditions for Ensemble Density Functional Theory
arXiv (Cornell University)·2023Open Access
Seven useful questions in density functional theory
Letters in Mathematical Physics·2023· 15 cited
Orbital-free functional with sub-milliHartree errors for slabs
arXiv (Cornell University)·2023Open Access
The difference between molecules and materials: Reassessing the role of exact conditions in density functional theory
arXiv (Cornell University)·2023· 1 citedOpen Access
SEMICLASSICS: THE HIDDEN THEORY BEHIND THE SUCCESS OF DFT
Lecture notes series, Institute For Mathematical Sciences·2023· 6 cited
Extending density functional theory with near chemical accuracy beyond pure water
Nature Communications·2023· 37 citedOpen Access
Leading Correction to the Local Density Approximation for Exchange in Large-<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>Z</mml:mi></mml:math> Atoms
Physical Review Letters·2022· 11 cited
Can the Hartree–Fock kinetic energy exceed the exact kinetic energy?
The Journal of Chemical Physics·2022· 5 cited
Asymptotics of eigenvalue sums when some turning points are complex
Journal of Physics A Mathematical and Theoretical·2022· 1 cited
Seven Useful Questions in Density Functional Theory
arXiv (Cornell University)·2022· 1 citedOpen Access
Extending density functional theory with near chemical accuracy beyond pure water
arXiv (Cornell University)·2022· 3 citedOpen Access
Lieb’s most useful contribution to density functional theory?
EMS Press eBooks·2022Open Access
Conditional probability density functional theory
Physical review. B./Physical review. B·2022· 8 citedOpen Access
Can the Hartree-Fock kinetic energy exceed the exact kinetic energy?
arXiv (Cornell University)·2022Open Access
Machine learning and density functional theory
Nature Reviews Physics·2022· 109 citedOpen Access
Correlation energy of the uniform electron gas determined by ground-state conditional probability density functional theory
Physical review. B./Physical review. B·2022· 2 citedOpen Access
Asymptotics of eigenvalue sums when some turning points are complex
arXiv (Cornell University)·2022Open Access
Improving Results by Improving Densities: Density-Corrected Density Functional Theory
Journal of the American Chemical Society·2022· 129 cited
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Frequent Co-authors

John P. Perdew(17), Matthias Ernzerhof(9), Eunji Sim(6), Neepa T. Maitra(4), Min Cheol Kim(4), Adrienn Ruzsinszky(3), Gustavo E. Scuseria(3), Lucian A. Constantin(3), Yue Wang(3), E. K. U. Gross(3), Klaus‐Robert Müller(3), Robert J. Cave(3), Suhwan Song(3), Gábor I. Csonka(2), Oleg A. Vydrov(2), Xiaolan Zhou(2), Miguel A. L. Marques(2), John Snyder(2), Matthias Rupp(2), Katja Hansen(2)