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Proceedings of the National Academy of Sciences of the United States of America|September 12, 2018
Describing strong correlation with fractional-spin correction in density functional theoryNeil Qiang Su, Chen Li, Weitao Yang
The Journal of Physical Chemistry. A|December 28, 2018
Approximating Quasiparticle and Excitation Energies from Ground State Generalized Kohn-Sham CalculationsYuncai Mei, Chen Li, Neil Qiang Su, et al.
The Journal of Physical Chemistry Letters|January 6, 2019
Renormalized Singles Green's Function for Quasi-Particle Calculations beyond the G<sub>0</sub> W<sub>0</sub> ApproximationYe Jin, Neil Qiang Su, Weitao Yang
The Journal of Physical Chemistry Letters|February 1, 2020
Preserving Symmetry and Degeneracy in the Localized Orbital Scaling Correction ApproachNeil Qiang Su, Aaron Mahler, Weitao Yang
JACS Au|July 5, 2022
Describing Chemical Reactivity with Frontier Molecular OrbitaletsJincheng Yu, Neil Qiang Su, Weitao Yang
The Journal of Physical Chemistry Letters|June 28, 2017
Accurate Quasiparticle Spectra from the T-Matrix Self-Energy and the Particle-Particle Random Phase ApproximationDu Zhang, Neil Qiang Su, Weitao Yang
Faraday Discussions|October 21, 2020
Introductory lecture: when the density of the noninteracting reference system is not the density of the physical system in density functional theoryYe Jin, Neil Qiang Su, Zehua Chen, et al.
The Journal of Chemical Physics|April 23, 2022
Combining localized orbital scaling correction and Bethe-Salpeter equation for accurate excitation energiesJiachen Li, Ye Jin, Neil Qiang Su, et al.
Physical Review. B|September 20, 2023
Localized orbital scaling correction for periodic systemsAaron Mahler, Jacob Williams, Neil Qiang Su, et al.
The Journal of Physical Chemistry. A|May 22, 2014
Fractional charge behavior and band gap predictions with the XYG3 type of doubly hybrid density functionalsNeil Qiang Su, Weitao Yang, Paula Mori-Sánchez, et al.
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