Kieron Burke

Q: What Schools Are Affiliated With Kieron Burke

Kieron Burke is affiliated with the following schools: University of California, Berkeley, University of California, Santa Barbara, University of California, Irvine, Rutgers University

Kieron Burke's AcademicInfluence.com Rankings

Kieron Burke

Chemistry

#2006

World Rank

#2846

Historical Rank

chemistry Degrees

Download Badge

Chemistry

Kieron Burke's Degrees

PhD Chemistry University of California, Irvine
Bachelors Chemistry University of California, Berkeley

Why Is Kieron Burke Influential?

(Suggest an Edit or Addition)

(See a Problem?)

Kieron Burke's Published Works

Number of citations in a given year to any of this author's works

Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author

Published Works

Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)] (1997) (9885)
Restoring the density-gradient expansion for exchange in solids and surfaces. (2007) (5232)
Rationale for mixing exact exchange with density functional approximations (1996) (4161)
Perspective on density functional theory. (2012) (1166)
Generalized gradient approximation for solids and their surfaces (2007) (1106)
Time-dependent density functional theory: past, present, and future. (2004) (733)
Perdew, Burke, and Ernzerhof Reply: (1998) (712)
Bypassing the Kohn-Sham equations with machine learning (2016) (480)
Finding Density Functionals with Machine Learning (2011) (415)
Basics of TDDFT (2006) (408)
Double excitations within time-dependent density functional theory linear response. (2004) (390)
Understanding band gaps of solids in generalized Kohn–Sham theory (2016) (345)
Extracting the jet transport coefficient from jet quenching in high-energy heavy-ion collisions (2014) (283)
Self-interaction errors in density-functional calculations of electronic transport. (2005) (231)
Erratum: Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces [Phys. Rev. Lett. 100 , 136406 (2008)] (2009) (224)
Derivation of a generalized gradient approximation: The PW91 density functional (1998) (222)
Comparison shopping for a gradient-corrected density functional (1996) (207)
The adiabatic connection method: a non-empirical hybrid (1997) (192)
Understanding and reducing errors in density functional calculations. (2012) (192)
Excited states from time-dependent density functional theory (2007) (176)
A dressed TDDFT treatment of the 21Ag states of butadiene and hexatriene (2004) (175)
Describing static correlation in bond dissociation by Kohn-Sham density functional theory. (2004) (166)
DFT in a nutshell (2013) (155)
Can optimized effective potentials be determined uniquely (2001) (153)
Erratum: Generalized gradient approximation for the exchange-correlation hole of a many-electron system [Phys. Rev. B 54 , 16 533 (1996)] (1998) (151)
COUPLING-CONSTANT DEPENDENCE OF ATOMIZATION ENERGIES (1997) (149)
DFT: A Theory Full of Holes? (2014) (146)
Why semilocal functionals work: Accuracy of the on-top pair density and importance of system averaging (1998) (145)
Excitations in time-dependent density-functional theory. (2002) (137)
Theoretical Investigation of the Ground and Excited States of Coumarin 151 and Coumarin 120 (2002) (132)
Memory in time-dependent density functional theory. (2002) (129)
Zero-bias molecular electronics: Exchange-correlation corrections to Landauer's formula (2005) (128)
Understanding Machine-learned Density Functionals (2014) (124)
Partition Density Functional Theory (2009) (123)
Distributions and averages of electron density parameters: Explaining the effects of gradient corrections (1997) (117)
Density functional theory of the electrical conductivity of molecular devices. (2005) (117)
Density functional calculations of nanoscale conductance (2007) (114)
Quantum chemical accuracy from density functional approximations via machine learning (2019) (111)
Why the generalized gradient approximation works and how to go beyond it (1997) (111)
Communication: Avoiding unbound anions in density functional calculations. (2011) (96)
Unambiguous exchange-correlation energy density (1998) (95)
On-Top Pair-Density Interpretation of Spin Density Functional Theory, with Applications to Magnetism (1997) (94)
Orbital-free bond breaking via machine learning. (2013) (93)
Relevance of the slowly varying electron gas to atoms, molecules, and solids. (2006) (86)
The Hubbard dimer: a density functional case study of a many-body problem (2015) (84)
Understanding Kernel Ridge Regression: Common behaviors from simple functions to density functionals (2015) (83)
Retrospective on a decade of machine learning for chemical discovery (2020) (81)
Ions in solution: density corrected density functional theory (DC-DFT). (2014) (81)
Guest Editorial: Special Topic on Data-Enabled Theoretical Chemistry. (2018) (79)
Pure density functional for strong correlation and the thermodynamic limit from machine learning (2016) (78)
The Importance of Being Inconsistent. (2016) (77)
Semiclassical origins of density functionals. (2008) (76)
Exchange-Correlation Energy Density from Virial Theorem (1998) (74)
Nonlocality of the density functional for exchange and correlation: Physical origins and chemical consequences (1998) (73)
Improved DFT Potential Energy Surfaces via Improved Densities. (2015) (72)
Density-Gradient Analysis for Density Functional Theory: Application to Atoms* (1997) (71)
Gedanken densities and exact constraints in density functional theory. (2014) (69)
Density Functional Partition Theory with Fractional Occupations. (2009) (68)
Lack of Hohenberg-Kohn theorem for excited states. (2004) (68)
Kohn-Sham equations as regularizer: building prior knowledge into machine-learned physics (2020) (67)
Condition on the Kohn-Sham kinetic energy and modern parametrization of the Thomas-Fermi density. (2008) (65)
Non-empirical derivation of the parameter in the B88 exchange functional (2009) (65)
Reference electronic structure calculations in one dimension. (2012) (64)
One-dimensional continuum electronic structure with the density-matrix renormalization group and its implications for density-functional theory. (2011) (64)
Several Theorems in Time-Dependent Density Functional Theory (1999) (63)
Accuracy of Electron Affinities of Atoms in Approximate Density Functional Theory (2010) (61)
Total energy density as an interpretative tool (1999) (61)
Bethe ansatz approach to the Kondo effect within density-functional theory. (2012) (60)
Benchmarks and Reliable DFT Results for Spin Gaps of Small Ligand Fe(II) Complexes. (2018) (59)
Demonstration of initial-state dependence in time-dependent density-functional theory (2000) (59)
Quantifying Density Errors in DFT. (2018) (57)
Excitation energies from time-dependent density-functional theory beyond the adiabatic approximation. (2004) (56)
Current-density functional theory of the response of solids (2002) (55)
Approximate Density Functionals: Which Should I Choose? (2009) (55)
Exact conditions in finite-temperature density-functional theory. (2010) (55)
A guided tour of time-dependent density functional theory (1998) (49)
Density Functionals: Where Do They Come from, Why Do They Work? (1996) (48)
Thermal Density Functional Theory: Time-Dependent Linear Response and Approximate Functionals from the Fluctuation-Dissipation Theorem. (2015) (48)
Long-range asymptotic behavior of ground-state wave functions, one-matrices, and pair densities (1996) (47)
EXACT HIGH-DENSITY LIMIT OF CORRELATION POTENTIAL FOR TWO-ELECTRON DENSITY (1999) (46)
Time-Dependent Density Functional Theory in Quantum Chemistry (2005) (46)
Thermal Density Functional Theory in Context (2013) (45)
Exact and approximate Kohn-Sham potentials in ensemble density-functional theory (2014) (43)
Density functional analysis: The theory of density-corrected DFT. (2019) (43)
Density-functional theory in one dimension for contact-interacting fermions (2004) (43)
Adiabatic connection from accurate wave-function calculations (1999) (42)
Perdew et al. Reply (2008) (41)
MIXING EXACT EXCHANGE WITH GGA: WHEN TO SAY WHEN (1998) (41)
Extracting jet transport coefficient from jet quenching at RHIC and LHC (2013) (41)
Accurate Rydberg excitations from the local density approximation. (2003) (41)
Polarizability of molecular chains: A self-interaction correction approach (2008) (40)
Correlation in time-dependent density-functional theory (2002) (39)
Excitations and benchmark ensemble density functional theory for two electrons. (2014) (39)
Direct Extraction of Excitation Energies from Ensemble Density-Functional Theory. (2017) (38)
Guaranteed convergence of the Kohn-Sham equations. (2013) (36)
Learning to Approximate Density Functionals. (2021) (36)
Testing the kinetic energy functional: Kinetic energy density as a density functional (2003) (36)
Kohn-Sham calculations with the exact functional (2014) (35)
Electronic structure via potential functional approximations. (2011) (34)
Communication: Ionization potentials in the limit of large atomic number. (2010) (34)
Can exact conditions improve machine-learned density functionals? (2018) (33)
Locality of correlation in density functional theory. (2016) (33)
Halogen and Chalcogen Binding Dominated by Density-Driven Errors. (2018) (32)
The Importance of being Consistent (2017) (31)
Linear response time-dependent density functional theory of the Hubbard dimer (2018) (30)
Fitting a round peg into a round hole: Asymptotically correcting the generalized gradient approximation for correlation. (2018) (30)
Time-dependent density functional theory of high excitations: to infinity, and beyond. (2009) (29)
Local and gradient-corrected density functionals (1996) (29)
Real‐space analysis of the exchange‐correlation energy (1995) (29)
Rydberg transition frequencies from the local density approximation. (2005) (29)
Accurate double excitations from ensemble density functional calculations. (2018) (28)
Density-potential mapping in time-dependent density-functional theory (2009) (28)
Roadmap on Machine learning in electronic structure (2022) (28)
Leading corrections to local approximations (2010) (28)
Adiabatic connection in the low-density limit (2009) (25)
One Dimensional Mimicking of Electronic Structure: The Case for Exponentials (2015) (25)
Nonlinear gradient denoising: Finding accurate extrema from inaccurate functional derivatives (2015) (25)
Comment on Critique of the foundations of time-dependent density-functional theory (2008) (24)
Corrections to Thomas-Fermi densities at turning points and beyond. (2014) (24)
Accuracy of density functionals for molecular electronics: The Anderson junction (2012) (23)
Adiabatic connection for near degenerate excited states (2004) (23)
Potential functionals versus density functionals (2013) (22)
Exact thermal density functional theory for a model system: Correlation components and accuracy of the zero-temperature exchange-correlation approximation (2015) (22)
Exact conditions on the temperature dependence of density functionals (2015) (22)
Finding electron affinities with approximate density functionals (2010) (22)
Ten topical questions in time-dependent density functional theory (2002) (22)
Density Sensitivity of Empirical Functionals. (2020) (22)
Design of a grating-based thin-film filter for broadband spectropolarimetry. (2003) (21)
Quantifying and Understanding Errors in Molecular Geometries. (2020) (21)
Which functional should I choose (2009) (21)
Measuring density-driven errors using Kohn-Sham inversion. (2020) (21)
Density-Corrected DFT Explained: Questions and Answers. (2021) (21)
On the Floquet formulation of time-dependent density functional theory (2002) (20)
Improving Results by Improving Densities: Density-Corrected Density Functional Theory. (2022) (19)
Adiabatic connection for strictly correlated electrons. (2009) (19)
Warming Up Density Functional Theory (2017) (18)
Comment on "Total energy method from many-body formulation". (2003) (17)
Density functional theory, the exchange hole, and the molecular bond (1996) (17)
Time-dependent density functional calculation of e-H scattering. (2007) (17)
VIRIAL EXCHANGE-CORRELATION ENERGY DENSITY IN HOOKE'S ATOM (1998) (16)
Machine learning and density functional theory (2022) (16)
Explaining and Fixing DFT Failures for Torsional Barriers. (2021) (16)
Erratum: Demonstration of initial-state dependence in time-dependent density-functional theory (Phys. Rev. A (2001) 63 (042501)) (2001) (15)
Continuum states from time-dependent density functional theory. (2005) (14)
Connection formulas for thermal density functional theory (2015) (14)
Measuring the kernel of time-dependent density functional theory with x-ray absorption spectroscopy of transition metals. (2005) (14)
The quantum defect: the true measure of time-dependent density-functional results for atoms. (2005) (14)
Kernels, Pre-images and Optimization (2013) (13)
Density functional description of Coulomb blockade: Adiabatic versus dynamic exchange correlation (2015) (12)
Corrigendum: The Hubbard dimer: a density functional case study of a many-body problem (2015 J. Phys.: Condens. Matter 27 393001) (2017) (12)
Charge transfer in partition theory. (2008) (12)
Probing a cold surface with slow heavy-atom scattering: Experimental results and theoretical calculations (2002) (12)
Rules for minimal atomic multipole expansion of molecular fields. (2003) (12)
Publisher's Note: Lack of Hohenberg-Kohn Theorem for Excited States [Phys. Rev. Lett.93, 173001 (2004)] (2005) (12)
Thermal Corrections to Density Functional Simulations of Warm Dense Matter (2015) (12)
UNAMBIGUOUS EXCHANGE-CORRELATION ENERGY DENSITY FOR HOOKE'S ATOM (1998) (12)
Comment on ''Analysis of Floquet formulation of time-dependent density-functional theory'' (Chem. Phys. Lett. 433 (2006) 204) (2007) (12)
Deriving uniform semiclassical approximations for one-dimensional fermionic systems. (2015) (11)
Kohn-Sham Master Equation Approach to Transport Through Single Molecules (2006) (11)
Exact and approximate energy sums in potential wells (2020) (11)
XMCD Analysis Beyond Standard Procedures (2007) (11)
Efficient prediction of 3D electron densities using machine learning (2018) (11)
Almost exact exchange at almost no computational cost in electronic structure (2015) (11)
Leading corrections to local approximations II : The case with turning points (2016) (11)
A new challenge for time-dependent density functional theory (2006) (10)
Effect of cusps in time-dependent quantum mechanics. (2011) (10)
Digging into the Exchange-Correlation Energy: The Exchange-Correlation Hole (1998) (10)
Semiclassics: The hidden theory behind the success of DFT (2021) (10)
A hybrid functional for the exchange-correlation kernel in time-dependent density functional theory (2000) (10)
Partition theory: a very simple illustration. (2007) (10)
The Importance of Being Self-Consistent (2016) (9)
Semilocal Density Functionals for Exchange and Correlation : Theory and Applications (9)
Nonlocal Density Functionals for Exchange and Correlation: Theory and Applications (1995) (8)
Bound states in time-dependent quantum transport : oscillations and memory effects in current and density (2009) (8)
Uncommonly accurate energies for the general quartic oscillator (2020) (8)
Exact Conditions and Their Relevance in TDDFT (2012) (8)
Exploration of surfaces by atomic scattering in the almost classical regime (1991) (8)
Coordinate scaling in time-dependent current-density-functional theory (2005) (8)
Leading correction to the local density approximation of the kinetic energy in one dimension. (2020) (8)
Double-pole approximation in time-dependent density functional theory (2005) (8)
MAP: an MP2 accuracy predictor for weak interactions from adiabatic connection theory. (2020) (8)
Simple hydrogenic estimates for the exchange and correlation energies of atoms and atomic ions, with implications for density functional theory. (2020) (7)
Communication: Testing and using the Lewin-Lieb bounds in density functional theory. (2014) (7)
Erratum: Several Theorems in Time-Dependent Density Functional Theory [Phys. Rev. Lett. 82, 378 (1999)] (1999) (7)
Special Issue in Honor of John P. Perdew for His 65th Birthday. (2009) (7)
Density Functionals with Quantum Chemical Accuracy : From Machine Learning to Molecular Dynamics (7)
Recent Developments in Density Functional Approximations (2020) (7)
Symmetry and degeneracy in density functional theory (2001) (7)
Nonexistence of a Taylor expansion in time due to cusps (2013) (7)
Quantum critical benchmark for electronic structure theory (2015) (6)
Must Kohn-Sham oscillator strengths be accurate at threshold? (2009) (6)
Relations between coordinate and potential scaling in the high-density limit. (2005) (6)
Generalized gradient approximation to the hole around an electron (1996) (6)
Bypassing the Energy Functional in Density Functional Theory: Direct Calculation of Electronic Energies from Conditional Probability Densities. (2020) (5)
The Pair Density in Approximate Density Functionals: The Hidden Agent (2000) (5)
Accurate correlation energies in one-dimensional systems from small system-adapted basis functions (2018) (5)
Improving Electronic Structure Calculations (2016) (5)
Confirmation of the PPLB Derivative Discontinuity: Exact Chemical Potential at Finite Temperatures of a Model System. (2020) (5)
Semiclassical quantization of truncated potentials (2019) (5)
Calculation and interpretation of classical turning surfaces in solids (2021) (5)
Density Functionals with Quantum Chemical Accuracy: From Machine Learning to Molecular Dynamics (2019) (4)
Lies My Teacher Told Me About Density Functional Theory: Seeing Through Them with the Hubbard Dimer (2021) (4)
Erratum: Guaranteed Convergence of the Kohn-Sham Equations [Phys. Rev. Lett. 111, 093003 (2013)] (2014) (4)
Accurate atomic quantum defects from particle–particle random phase approximation (2015) (4)
Exact density functional theory with the density matrix renormalization group (2011) (4)
Scaling the spin densities separately in density-functional theory (2002) (4)
Ab initio study of H2 dissociation and vibrational relaxation in mixtures of He and Ar: Implications for the linear mixture rule (1987) (4)
DENSITY FUNCTIONALS AND SMALL INTERPARTICLE SEPARATIONS IN ELECTRONIC SYSTEMS (1995) (4)
Non-empirical 'derivation' of B88 exchange functional (2009) (3)
Testing and using the Lewin-Lieb bounds in density functional theory (2014) (3)
Deriving approximate functionals with asymptotics. (2020) (3)
Density functional theory of dissipative systems (2004) (3)
Electron-molecule scattering from time-dependent density functional theory (3)
Atomic correlation energies and the generalized gradient approximation (2014) (3)
Why Density-Gradient Corrections Improve Atomization Energies and Barrier Heights (1998) (3)
Probing surface lattice dynamics with hyperthermal ion scattering (1994) (3)
What is time-dependent density functional theory? Successes and Challenges (2002) (3)
Erratum: One-dimensional mimicking of electronic structure: The case for exponentials [Phys. Rev. B 91, 235141 (2015)] (2016) (3)
Thermal stitching: Combining the advantages of different quantum fermion solvers (2018) (2)
Challenges for large scale simulation: general discussion. (2020) (2)
How Well Does Kohn-Sham Regularizer Work for Weakly Correlated Systems? (2021) (2)
Comment on "Application of partition density-functional theory to one-dimensional models" (2014) (2)
Comment on"Critique of the foundations of time-dependent density functional theory"[Phys. Rev.A. 75, 022513 (2007)] (2007) (2)
Pride, Prejudice, and Penury of ab initio Transport Calculations for Single Molecules (2006) (2)
Asymptotics of eigenvalue sums when some turning points are complex (2022) (2)
Publisher’s Note: Density Functional Theory of the Electrical Conductivity of Molecular Devices [Phys. Rev. Lett.94, 146803 (2005)] (2005) (2)
Can the Hartree-Fock kinetic energy exceed the exact kinetic energy? (2022) (2)
Leading Correction to the Local Density Approximation for Exchange in Large-Z Atoms. (2022) (2)
Viewpoint: Improving Electronic Structure Calculations (2016) (2)
Chemistry in 1d via DMRG: Benchmarks for small atoms, ions, and molecules (2012) (2)
Reference electronic structure calculations in one dimension w (2012) (2)
Conditional probability density functional theory (2022) (2)
Kondo effect given exactly by density functional theory (2011) (2)
The Role of Exact Conditions in TDDFT (2011) (1)
Chemical accuracy from small, system-adapted basis functions (2017) (1)
Thermal stitching: Extending the reach of quantum fermion solvers (2018) (1)
One-dimensional Continuum Electronic Structure Calculations with the Density Matrix Renormalization Group (2011) (1)
Classifying and reducing errors in density functional calculations (2012) (1)
Almost Exact Exchange At Almost No Cost (2014) (1)
Exact ensemble density-functional theory for excited states (2014) (1)
Erratum: Density-functional theory in one dimension for contact-interacting fermions [Phys. Rev. A 70, 032508 (2004)] (2005) (1)
Density Functional Theory: A great physics success story (2012) (1)
New approaches to study excited states in density functional theory: general discussion. (2020) (1)
Scattering amplitudes from time-dependent density functional theory (2004) (1)
New density-functional approximations and beyond: general discussion. (2020) (1)
Reassessing the role of exact conditions in density functional theory (2023) (1)
Linear-response thermal time-dependent density functional theory (2015) (1)
Efficient prediction of 3 D electron densities using machine learning (2018) (1)
Interacting Electrons: Theory and Computational Approaches (2017) (1)
How errors in densities contaminate empirical density functionals (2020) (1)
Benchmarks and reliable DFT results for spin-crossover complexes (2017) (1)
Applications of Quantum Mechanics (2010) (1)
A ug 2 01 4 DFT : A Theory Full of Holes ? (2014) (1)
The quantum defect: the true measure of TDDFT results for atoms (2006) (1)
Acknowledgment of Guest Editors, 2019 (2019) (1)
On the validity of the trajectory approximation in quasi-adiabatic atom-surface scattering (1991) (1)
Seven useful questions in density functional theory (2022) (1)
Exact condition on the non-interacting kinetic energy for real matter (2008) (0)
Thermal connection formula and linear response time-dependent density functional theory for thermal ensembles (2016) (0)
Scaling in time dependent current density functional theory (2005) (0)
Probing the Structure of Density Functional Theory with Density Matrix Renormalization Group (2015) (0)
Absorption and fluorescence properties of oligothiophene biomarkers from long-range-corrected time-dependent density functional theory w (2009) (0)
Correction to "Halogen and Chalcogen Binding Dominated by Density-Driven Errors". (2020) (0)
Bypassing the equations with machine learning. (2017) (0)
Test of the validity of the gradient expansion for slowly-varying extended systems and coefficients of the sixth order for the KE in 1 d (2012) (0)
Uniform semiclassical approximations for many-particle systems (2014) (0)
Linear response time-dependent density functional theory of the Hubbard dimer (2018) (0)
Density Functional Theory and Semiclassical Methods (2009) (0)
Construction of the Integrand of Adiabatic Connection: An Exact Condition for the Low-Density Limit (2009) (0)
Density Functional Partition Theory (2009) (0)
DFT-based transport calculations for single molecules: Can Coulomb blockade effects be reproduced by local functionals? (2007) (0)
Electron-atom scattering using time-dependent density-functional theory (2007) (0)
Exact and Approximate Ensemble Density Functionals for a Simple model (2018) (0)
Electronic structure from conditional probabilities (2020) (0)
Response to comment (2021) (0)
11 Exact Conditions (2006) (0)
Reliable prediction of the reaction barrier height with HF-DFT (2018) (0)
DFT in a nutshell-v 1 . 1 (2010) (0)
Essential difference between the machine learning and artificial Kohn-Sham potentials (2020) (0)
A new approach to density functional theory (2008) (0)
Of Sandboxes and Silences (2003) (0)
Leading Corrections to the Local Density Approximation (2010) (0)
Exquisitely accurate energies for the general quartic oscillator (2020) (0)
Can ensemble density functional theory yield accurate double excitations? (2018) (0)
Quantum critical benchmark for density functional theory (2014) (0)
The unreasonable accuracy of asymptotic expansions: Why density functional theory works (2010) (0)
Electron Affinity in Approximate Density Functional Theory and the Role of Semiclassics in Orbital-Free Potential-Density Functional Theory (2010) (0)
Non-Empirical Orbital-Free Approximations from Semiclassical Approaches (2013) (0)
Finding the Right Density from the Wrong Temperature with Thermal Density Functional Theory (2018) (0)
Supplemental material for “Direct extraction of excitation energies from ensemble density-functional theory” (2017) (0)
Testing Machine Learning Methods on Density Functional Theory and Simple Toy Model (2013) (0)
Band Gap Studies in Density Functional Theory (2015) (0)
Essentials of 54 years of functional development in physical sciences (REVIEW) (2019) (0)
Applying Exact Conditions to Machine Learned Density Functionals (2018) (0)
Is Density Functional Theory adequate for quantum transport (2007) (0)
Explicit corrections to the gradient expansion for the kinetic energy in one dimension. (2019) (0)
WMES 2020 (2020) (0)
Lieb's most useful contribution to density functional theory? (2022) (0)
Rydberg transitions from the local density approximation (2006) (0)
Generalizability of density functionals learned from differentiable programming on weakly correlated spin-polarized systems (2021) (0)
Towards a semiclassical theory of electronic structure (2009) (0)
Exact density functionals for 1d systems (2012) (0)
A current-density functional approach to the electronic conductance of molecular wire junctions (2003) (0)
The Hubbard Dimer: A Complete DFT Solution to a Many-Body Problem (2015) (0)
Two new approaches for electronic structure: Partition Density Functional Theory and Potential Functional Theory (2009) (0)
Understanding Machine-learned Density Functionals 1 LI LI, JOHN (2013) (0)
Obituary of David Langreth (1937-2011) (2011) (0)
Polarizability of molecular chains: does one need exact exchange? (2007) (0)
Density Functional Theory with Dissipation: Transport through Single Molecules (2012) (0)
The Hubbard dimer: exact dynamic exchange-correlation kernel, single and double excitations of a strongly correlated problem (2017) (0)
Ensemble density-functional theory for excited states: exact results versus approximations (2014) (0)
Developing surface probes for fun and profit (1995) (0)
Orbital-free functional with sub-milliHartree errors for slabs (2023) (0)
Semiclassical approach to the exchange energy from potential functional theory (2014) (0)
Leading approximations to local corrections II: The case with turning points (2017) (0)
Leading corrections to local approximations II (with turning points) (2016) (0)
231 B w 10 : Applications of Quantum Mechanics (2010) (0)
Accurate Parametrization of the Non-Interacting Kinetic Energy of the Thermal Uniform Gas (2018) (0)
An Exact Condition for the Integrand of Adiabatic Connection (2009) (0)
Correlation energy of the uniform electron gas determined by ground-state conditional probability density functional theory (2022) (0)
Fitting a Round Peg into a Round Hole -- Constructing an Asymptotically Correct Generalized Gradient Approximation. (2018) (0)
QMC Data sets for Benchmarks and Reliable DFT Results for Spin Gaps of Small Ligand Fe(II) Complexes (2018) (0)
Mean-field modeling and multiscale methods for complex physical and biological system (2016) (0)
Ten topical questions in time dependent functional theory (2002) (0)
TITLE:: HIGH TEMPERATURE RESISTANCE AND REACTIVITY OF CARBON NANOTUBE ELECTRONIC CIRCUITS (2010) (0)
Using Machine Learning to Find New Density Functionals (2021) (0)
A Guided Tour of Mathematical Methods for the Physical Sciences (2002) (0)
Coulomb blockade in Anderson junction without time-dependent density functional theory (2015) (0)
A new definition of the kinetic energy density (2002) (0)
Excitation energies from TDDFT beyond the adiabatic approximation (2003) (0)
Classical turning surfaces in solids: When do they occur, and what do they mean? (2020) (0)
Benchmarking Density Functional Theory with Density Matrix Renormalization Group and Lessons For Higher Dimensions (2014) (0)
Investigating density functional theory with the density matrix renormalization group (2017) (0)
Uniform approximations for fermionic densities (2014) (0)
Topic on Data-enabled Theoretical Chemistry (2018) (0)
Theory of the phonon dephasing mechanism for vibrational lineshapes at surfaces (1994) (0)
Speeding Up DFT Calculations with Machine Learning (2017) (0)
Semiclassical origins of density functional theory (2009) (0)
Connecting Quantum and Classical DFT (2018) (0)
Molecular conductance at finite voltage: bias driven evolution of Kohn-Sham-orbitals (2006) (0)
A ug 2 02 0 Simple hydrogenic estimates for the exchange and correlation energies of atoms and atomic ions , with implications for density functional theory (2021) (0)
Extending density functional theory with near chemical accuracy beyond pure water (2022) (0)
Strong correlation in time-dependent density functional theory (2018) (0)
DFT calculations with the exact functional (2014) (0)
Semiclassics in Density Functional Theory (2009) (0)
Semiclassical Approximation to Sums of Eigenvalues with Application to DFT (2020) (0)
Ions on the verge of ionization (2006) (0)
Two electrons in a magnetic field (1997) (0)
Systematic method to improve first principle calculations of materials under extreme conditions (2017) (0)
Testing the Standard Approach for Density-Functional Transport Calculations (2014) (0)
Ju n 20 06 A new challenge for time-dependent density-functional theory (2006) (0)
Adiabatic Connection and Virial Theorem for Ensemble Density Functional Theory (2014) (0)
Chapter 30 Local and Gradient-Corrected Density Functionals (2009) (0)
Expansion of Bose-Einstein condensates in disorder : Anderson localization and wave chaos (0)
On the Edge of Koopmans' Theorem (2014) (0)
Dissociation curves of diatomic molecules: A DC-DFT study (2015) (0)
MAME: Minimal Atomic Multipole Expansion of Molecular Fields (2004) (0)
Bypassing the Kohn-Sham equations with machine learning (2017) (0)
Comparing Exact Charge Gaps to Exact DFT and DFT Approximations for Extended 1D Continuum Systems (2013) (0)
Systematic method for improving first principle calculations of materials under extreme conditions (2016) (0)
Atom Scattering from Solid Surfaces. (1989) (0)
Importance of cusps in TDDFT (2010) (0)
Bob Cave Memorial. (2021) (0)
A density functional that works for transport through Anderson junction (2012) (0)
DFT treatment of transport through Anderson junction: exact results and approximations (2012) (0)
Semiclassical Approaches in Density Functional Theory (2008) (0)
Generation of Accurate and Transferable Pseudopotentials for Nuclear Magnetic Resonance (2019) (0)
Publisher's Note: Pure density functional for strong correlation and the thermodynamic limit from machine learning [Phys. Rev. B 94 , 245129 (2016)] (2021) (0)
Potential Scaling in Density Functional Theory (2009) (0)
O ct 2 00 4 Describing static correlation in bond dissociation by Kohn-Sham density functional theory (2008) (0)
Determination Of Jet Transport Parameters And Their Temperature Dependence In Heavy-Ion Collisions (2014) (0)

This paper list is powered by the following services:

What Schools Are Affiliated With Kieron Burke?

Kieron Burke is affiliated with the following schools: