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Ying Zhu
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Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
E Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ...
The Journal of chemical physics 155 (8), 2021
6512021
Self-consistent predictor/corrector algorithms for stable and efficient integration of the time-dependent Kohn-Sham equation
Y Zhu, JM Herbert
The Journal of chemical physics 148 (4), 2018
442018
High harmonic spectra computed using time-dependent Kohn–Sham theory with Gaussian orbitals and a complex absorbing potential
Y Zhu, JM Herbert
The Journal of Chemical Physics 156 (20), 2022
132022
Jász
E Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ...
Ji, H, 0
7
Time-dependent density functional theory for x-ray absorption spectra: Comparing the real-time approach to linear response
JM Herbert, Y Zhu, B Alam, AK Ojha
Journal of Chemical Theory and Computation 19 (19), 6745-6760, 2023
62023
Broadband x-ray absorption spectra from time-dependent Kohn-Sham calculations
Y Zhu, B Alam, J Herbert
62021
Implementation of real-time time-dependent density functional theory and applications from the weak field to the strong field regime
Y Zhu
The Ohio State University, 2020
22020
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
W Skomorowski, PR Horn, AF White, P Pokhilko, N Mardirossian, Y Mao, ...
Journal of Chemical Physics, 2021
2021
A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response
Y Zhu
The Ohio State University, 2016
2016
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Articles 1–9