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Frontiers in Chemistry
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November 30, 2020
TAO-DFT-Based <i>Ab Initio</i> Molecular Dynamics
Shaozhi Li, Jeng-Da Chai
Journal of Chemical Theory and Computation
|
September 29, 2025
Optimization of B97-Type Density Functional Approximation, Global Hybrid, and Range-Separated Hybrid Energy Functionals with the D4 Dispersion Corrections in TAO-DFT
Shaozhi Li, Jeng-Da Chai
Nanoscale
|
August 3, 2013
Vertical-strain-induced spin-splitting in zigzag graphene nanoribbons
Ding Yi, Dong Hou, Shaozhi Li, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
May 1, 2023
Composite Hydrogel for the Targeted Capture and Photothermal Killing of Bacteria toward Facilitating Wound Healing
Yue Cao, Yifan Guo, Yingzheng Yin, et al.
Physical Review. E
|
July 15, 2016
Orbital-selective Mott phases of a one-dimensional three-orbital Hubbard model studied using computational techniques
Guangkun Liu, Nitin Kaushal, Shaozhi Li, et al.
Nature Communications
|
April 7, 2023
Testing electron-phonon coupling for the superconductivity in kagome metal CsV<sub>3</sub>Sb<sub>5</sub>
Yigui Zhong, Shaozhi Li, Hongxiong Liu, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
Frontiers in Chemistry
|
November 30, 2020
TAO-DFT-Based <i>Ab Initio</i> Molecular Dynamics
Shaozhi Li, Jeng-Da Chai
Journal of Chemical Theory and Computation
|
September 29, 2025
Optimization of B97-Type Density Functional Approximation, Global Hybrid, and Range-Separated Hybrid Energy Functionals with the D4 Dispersion Corrections in TAO-DFT
Shaozhi Li, Jeng-Da Chai
Nanoscale
|
August 3, 2013
Vertical-strain-induced spin-splitting in zigzag graphene nanoribbons
Ding Yi, Dong Hou, Shaozhi Li, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
May 1, 2023
Composite Hydrogel for the Targeted Capture and Photothermal Killing of Bacteria toward Facilitating Wound Healing
Yue Cao, Yifan Guo, Yingzheng Yin, et al.
Physical Review. E
|
July 15, 2016
Orbital-selective Mott phases of a one-dimensional three-orbital Hubbard model studied using computational techniques
Guangkun Liu, Nitin Kaushal, Shaozhi Li, et al.
Nature Communications
|
April 7, 2023
Testing electron-phonon coupling for the superconductivity in kagome metal CsV<sub>3</sub>Sb<sub>5</sub>
Yigui Zhong, Shaozhi Li, Hongxiong Liu, et al.
Page
of 1