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Aaron Kaplan
Aaron Kaplan
Postdoctoral Scholar, LBL
Verified email at lbl.gov
Title
Cited by
Cited by
Year
Accurate and Numerically Efficient r2SCAN Meta-Generalized Gradient Approximation
JW Furness, AD Kaplan, J Ning, JP Perdew, J Sun
The journal of physical chemistry letters 11 (19), 8208-8215, 2020
4732020
r2SCAN-D4: Dispersion corrected meta-generalized gradient approximation for general chemical applications
S Ehlert, U Huniar, J Ning, JW Furness, J Sun, AD Kaplan, JP Perdew, ...
The Journal of Chemical Physics 154 (6), 2021
922021
Interpretations of ground-state symmetry breaking and strong correlation in wavefunction and density functional theories
JP Perdew, A Ruzsinszky, J Sun, NK Nepal, AD Kaplan
Proceedings of the National Academy of Sciences 118 (4), e2017850118, 2021
712021
The predictive power of exact constraints and appropriate norms in density functional theory
AD Kaplan, M Levy, JP Perdew
Annual Review of Physical Chemistry 74, 193-218, 2023
362023
Construction of meta-GGA functionals through restoration of exact constraint adherence to regularized SCAN functionals
JW Furness, AD Kaplan, J Ning, JP Perdew, J Sun
The Journal of Chemical Physics 156 (3), 2022
332022
Workhorse minimally empirical dispersion-corrected density functional with tests for weakly bound systems:
J Ning, M Kothakonda, JW Furness, AD Kaplan, S Ehlert, JG Brandenburg, ...
Physical Review B 106 (7), 075422, 2022
292022
Understanding density-driven errors for reaction barrier heights
AD Kaplan, C Shahi, P Bhetwal, RK Sah, JP Perdew
Journal of Chemical Theory and Computation 19 (2), 532-543, 2023
172023
Collapse of the electron gas from three to two dimensions in Kohn-Sham density functional theory
AD Kaplan, K Wagle, JP Perdew
Physical Review B 98 (8), 085147, 2018
172018
Laplacian-level meta-generalized gradient approximation for solid and liquid metals
AD Kaplan, JP Perdew
Physical Review Materials 6 (8), 083803, 2022
162022
Symmetry breaking with the SCAN density functional describes strong correlation in the singlet carbon dimer
JP Perdew, STUR Chowdhury, C Shahi, AD Kaplan, D Song, EJ Bylaska
The Journal of Physical Chemistry A 127 (1), 384-389, 2022
152022
Testing the r2SCAN Density Functional for the Thermodynamic Stability of Solids with and without a van der Waals Correction
M Kothakonda, AD Kaplan, EB Isaacs, CJ Bartel, JW Furness, J Ning, ...
ACS Materials Au 3 (2), 102-111, 2022
152022
First-principles wave-vector-and frequency-dependent exchange-correlation kernel for jellium at all densities
AD Kaplan, NK Nepal, A Ruzsinszky, P Ballone, JP Perdew
Physical Review B 105 (3), 035123, 2022
112022
Simple hydrogenic estimates for the exchange and correlation energies of atoms and atomic ions, with implications for density functional theory
AD Kaplan, B Santra, P Bhattarai, K Wagle, P Bhetwal, J Yu, H Tang, ...
The Journal of chemical physics 153 (7), 2020
102020
Calculation and interpretation of classical turning surfaces in solids
AD Kaplan, SJ Clark, K Burke, JP Perdew
npj Computational Materials 7 (1), 25, 2021
82021
CPT invariance in classical electrodynamics
AD Kaplan, TD Tsankov
European Journal of Physics 38 (6), 065205, 2017
82017
ST u
AD Kaplan, B Santra, P Bhattarai, K Wagle
R. Chowdhury, P. Bhetwal, J. Yu, H. Tang, K. Burke, M. Levy, and JP Perdew …, 2020
62020
Unconventional error cancellation explains the success of Hartree–Fock density functional theory for barrier heights
B Kanungo, AD Kaplan, C Shahi, V Gavini, JP Perdew
The Journal of Physical Chemistry Letters 15 (1), 323-328, 2024
52024
Progress towards understanding ultranonlocality through the wave-vector and frequency dependence of approximate exchange-correlation kernels
NK Nepal, AD Kaplan, JM Pitarke, A Ruzsinszky
Physical Review B 104 (12), 125112, 2021
42021
Predicting the properties of NiO with density functional theory: Impact of exchange and correlation approximations and validation of the r2SCAN functional
MJ DelloStritto, AD Kaplan, JP Perdew, ML Klein
APL Materials 11 (6), 2023
32023
Symmetry breaking and self-interaction correction in the chromium atom and dimer
R Maniar, KPK Withanage, C Shahi, AD Kaplan, JP Perdew, ...
The Journal of Chemical Physics 160 (14), 2024
22024
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Articles 1–20