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Journal of Chemical Theory and Computation
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December 14, 2016
Ensemble-Average Representation of Pt Clusters in Conditions of Catalysis Accessed through GPU Accelerated Deep Neural Network Fitting Global Optimization
Huanchen Zhai, Anastassia N Alexandrova
The Journal of Physical Chemistry Letters
|
October 4, 2018
Correction to "Local Fluxionality of Surface-Deposited Cluster Catalysts: The Case of Pt<sub>7</sub> on Al<sub>2</sub>O<sub>3</sub>"
Huanchen Zhai, Anastassia N Alexandrova
The Journal of Physical Chemistry Letters
|
March 20, 2018
Local Fluxionality of Surface-Deposited Cluster Catalysts: The Case of Pt<sub>7</sub> on Al<sub>2</sub>O<sub>3</sub>
Huanchen Zhai, Anastassia N Alexandrova
The Journal of Chemical Physics
|
July 9, 2021
Low communication high performance ab initio density matrix renormalization group algorithms
Huanchen Zhai, Garnet Kin-Lic Chan
The Journal of Chemical Physics
|
November 1, 2022
A comparison between the one- and two-step spin-orbit coupling approaches based on the ab initio density matrix renormalization group
Huanchen Zhai, Garnet Kin-Lic Chan
Journal of Chemical Theory and Computation
|
November 18, 2015
AFFCK: Adaptive Force-Field-Assisted ab Initio Coalescence Kick Method for Global Minimum Search
Huanchen Zhai, Mai-Anh Ha, Anastassia N Alexandrova
Journal of Chemical Theory and Computation
|
October 19, 2023
An Ab Initio Correction Vector Restricted Active Space Approach to the L-Edge XAS and 2p3d RIXS Spectra of Transition Metal Complexes
Seunghoon Lee, Huanchen Zhai, Garnet Kin-Lic Chan
The Journal of Chemical Physics
|
July 7, 2025
Quantum many-body linear algebra, Hamiltonian moments, and a coupled-cluster inspired framework
Yuhang Ai, Huanchen Zhai, Johannes Tölle, et al.
Science (New York, N.Y.)
|
September 8, 2022
Systematic electronic structure in the cuprate parent state from quantum many-body simulations
Zhi-Hao Cui, Huanchen Zhai, Xing Zhang, et al.
Journal of Chemical Theory and Computation
|
January 21, 2022
Matrix Product States with Large Sites
Henrik R Larsson, Huanchen Zhai, Klaas Gunst, et al.
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Search research articles
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Showing results (1-10 of 37) with videos related to
Sort By:
Page
of 4
Journal of Chemical Theory and Computation
|
December 14, 2016
Ensemble-Average Representation of Pt Clusters in Conditions of Catalysis Accessed through GPU Accelerated Deep Neural Network Fitting Global Optimization
Huanchen Zhai, Anastassia N Alexandrova
The Journal of Physical Chemistry Letters
|
October 4, 2018
Correction to "Local Fluxionality of Surface-Deposited Cluster Catalysts: The Case of Pt<sub>7</sub> on Al<sub>2</sub>O<sub>3</sub>"
Huanchen Zhai, Anastassia N Alexandrova
The Journal of Physical Chemistry Letters
|
March 20, 2018
Local Fluxionality of Surface-Deposited Cluster Catalysts: The Case of Pt<sub>7</sub> on Al<sub>2</sub>O<sub>3</sub>
Huanchen Zhai, Anastassia N Alexandrova
The Journal of Chemical Physics
|
July 9, 2021
Low communication high performance ab initio density matrix renormalization group algorithms
Huanchen Zhai, Garnet Kin-Lic Chan
The Journal of Chemical Physics
|
November 1, 2022
A comparison between the one- and two-step spin-orbit coupling approaches based on the ab initio density matrix renormalization group
Huanchen Zhai, Garnet Kin-Lic Chan
Journal of Chemical Theory and Computation
|
November 18, 2015
AFFCK: Adaptive Force-Field-Assisted ab Initio Coalescence Kick Method for Global Minimum Search
Huanchen Zhai, Mai-Anh Ha, Anastassia N Alexandrova
Journal of Chemical Theory and Computation
|
October 19, 2023
An Ab Initio Correction Vector Restricted Active Space Approach to the L-Edge XAS and 2p3d RIXS Spectra of Transition Metal Complexes
Seunghoon Lee, Huanchen Zhai, Garnet Kin-Lic Chan
The Journal of Chemical Physics
|
July 7, 2025
Quantum many-body linear algebra, Hamiltonian moments, and a coupled-cluster inspired framework
Yuhang Ai, Huanchen Zhai, Johannes Tölle, et al.
Science (New York, N.Y.)
|
September 8, 2022
Systematic electronic structure in the cuprate parent state from quantum many-body simulations
Zhi-Hao Cui, Huanchen Zhai, Xing Zhang, et al.
Journal of Chemical Theory and Computation
|
January 21, 2022
Matrix Product States with Large Sites
Henrik R Larsson, Huanchen Zhai, Klaas Gunst, et al.
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of 4