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Jianwei Sun
Jianwei Sun
Associate Professor of Department of Physics and Engineering Physics, Tulane University
Verified email at tulane.edu
Title
Cited by
Cited by
Year
Strongly Constrained and Appropriately Normed Semilocal Density Functional
J Sun, A Ruzsinszky, JP Perdew
Physical Review Letters 115 (3), 036402, 2015
30042015
Density functional theory is straying from the path toward the exact functional
MG Medvedev, IS Bushmarinov, J Sun, JP Perdew, KA Lyssenko
Science 355 (6320), 49-52, 2017
9742017
Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional
J Sun, RC Remsing, Y Zhang, Z Sun, A Ruzsinszky, H Peng, Z Yang, ...
Nature chemistry 8 (9), 831, 2016
8602016
Workhorse semilocal density functional for condensed matter physics and quantum chemistry
JP Perdew, A Ruzsinszky, GI Csonka, LA Constantin, J Sun
Physical review letters 103 (2), 026403, 2009
7132009
Versatile van der Waals Density Functional Based on a Meta-Generalized Gradient Approximation
H Peng, ZH Yang, JP Perdew, J Sun
Physical Review X 6 (4), 041005, 2016
6302016
Understanding band gaps of solids in generalized Kohn–Sham theory
JP Perdew, W Yang, K Burke, Z Yang, EKU Gross, M Scheffler, ...
Proceedings of the National Academy of Sciences 114 (11), 2801-2806, 2017
4922017
Some fundamental issues in ground-state density functional theory: A guide for the perplexed
JP Perdew, A Ruzsinszky, LA Constantin, J Sun, GI Csonka
Journal of Chemical Theory and Computation 5 (4), 902-908, 2009
4502009
Accurate and numerically efficient rSCAN meta-generalized gradient approximation
JW Furness, AD Kaplan, J Ning, JP Perdew, J Sun
arXiv preprint arXiv:2008.03374, 2020
4472020
Self-consistent meta-generalized gradient approximation within the projector-augmented-wave method
J Sun, M Marsman, GI Csonka, A Ruzsinszky, P Hao, YS Kim, G Kresse, ...
Physical Review B 84 (3), 035117, 2011
2632011
Energetics of MnO 2 polymorphs in density functional theory
DA Kitchaev, H Peng, Y Liu, J Sun, JP Perdew, G Ceder
Physical Review B 93 (4), 045132, 2016
2572016
Comparative first-principles studies of prototypical ferroelectric materials by LDA, GGA, and SCAN meta-GGA
Y Zhang, J Sun, JP Perdew, X Wu
Physical Review B 96 (3), 035143, 2017
2342017
Properties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality
A Patra, JE Bates, J Sun, JP Perdew
Proceedings of the National Academy of Sciences, 201713320, 2017
2142017
Semilocal and hybrid meta-generalized gradient approximations based on the understanding of the kinetic-energy-density dependence
J Sun, R Haunschild, B Xiao, IW Bulik, GE Scuseria, JP Perdew
The Journal of Chemical Physics 138 (4), 044113, 2013
2132013
Density Functionals that Recognize Covalent, Metallic, and Weak Bonds
J Sun, B Xiao, Y Fang, R Haunschild, P Hao, A Ruzsinszky, GI Csonka, ...
Physical Review Letters 111 (10), 106401, 2013
2042013
Efficient first-principles prediction of solid stability: Towards chemical accuracy
Y Zhang, DA Kitchaev, J Yang, T Chen, ST Dacek, RA Sarmiento-Pérez, ...
npj Computational Materials 4 (1), 9, 2018
1922018
More realistic band gaps from meta-generalized gradient approximations: Only in a generalized Kohn-Sham scheme
Z Yang, H Peng, J Sun, JP Perdew
Physical Review B 93 (20), 205205, 2016
1812016
Communication: Effect of the orbital-overlap dependence in the meta generalized gradient approximation
J Sun, B Xiao, A Ruzsinszky
Journal of Chemical Physics 137 (5), 051101, 2012
1602012
Semilocal density functional obeying a strongly tightened bound for exchange
J Sun, JP Perdew, A Ruzsinszky
Proceedings of the National Academy of Sciences 112 (3), 685-689, 2015
1432015
van der Waals bilayer energetics: Generalized stacking-fault energy of graphene, boron nitride, and graphene/boron nitride bilayers
S Zhou, J Han, S Dai, J Sun, DJ Srolovitz
Physical Review B 92 (15), 155438, 2015
1362015
An accurate first-principles treatment of doping-dependent electronic structure of high-temperature cuprate superconductors
JW Furness, Y Zhang, C Lane, IG Buda, B Barbiellini, RS Markiewicz, ...
Communications Physics 1 (1), 11, 2018
1322018
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