Finite-Temperature TD-DMRG for the Carrier Mobility of Organic Semiconductors
Li, Weitang, Ren, Jiajun, Shuai, Zhigang
Published in The journal of physical chemistry letters (02.07.2020)
Published in The journal of physical chemistry letters (02.07.2020)
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Journal Article
Computational Method for Evaluating the Thermoelectric Power Factor for Organic Materials Modeled by the Holstein Model: A Time-Dependent Density Matrix Renormalization Group Formalism
Ge, Yufei, Li, Weitang, Ren, Jiajun, Shuai, Zhigang
Published in Journal of chemical theory and computation (08.11.2022)
Published in Journal of chemical theory and computation (08.11.2022)
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Journal Article
Understanding Carrier Transport in Organic Semiconductors: Computation of Charge Mobility Considering Quantum Nuclear Tunneling and Delocalization Effects
Jiang, Yuqian, Geng, Hua, Li, Weitang, Shuai, Zhigang
Published in Journal of chemical theory and computation (12.03.2019)
Published in Journal of chemical theory and computation (12.03.2019)
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Journal Article
Hybrid Quantum-Classical Boson Sampling Algorithm for Molecular Vibrationally Resolved Electronic Spectroscopy with Duschinsky Rotation and Anharmonicity
Wang, Yuanheng, Ren, Jiajun, Li, Weitang, Shuai, Zhigang
Published in The journal of physical chemistry letters (21.07.2022)
Published in The journal of physical chemistry letters (21.07.2022)
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Journal Article
Toward practical quantum embedding simulation of realistic chemical systems on near-term quantum computers
Li, Weitang, Huang, Zigeng, Cao, Changsu, Huang, Yifei, Shuai, Zhigang, Sun, Xiaoming, Sun, Jinzhao, Yuan, Xiao, Lv, Dingshun
Published in Chemical science (Cambridge) (10.08.2022)
Published in Chemical science (Cambridge) (10.08.2022)
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Journal Article
Efficient and Robust Parameter Optimization of the Unitary Coupled-Cluster Ansatz
Li, Weitang, Ge, Yufei, Zhang, Shi-Xin, Chen, Yu-Qin, Zhang, Shengyu
Published in Journal of chemical theory and computation (14.05.2024)
Published in Journal of chemical theory and computation (14.05.2024)
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Journal Article
TenCirChem: An Efficient Quantum Computational Chemistry Package for the NISQ Era
Li, Weitang, Allcock, Jonathan, Cheng, Lixue, Zhang, Shi-Xin, Chen, Yu-Qin, Mailoa, Jonathan P., Shuai, Zhigang, Zhang, Shengyu
Published in Journal of chemical theory and computation (11.07.2023)
Published in Journal of chemical theory and computation (11.07.2023)
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Journal Article
Thruster
Cartwright, Iain, Li, Weitang, Wu, Xioafeng, Mehta, Shyam, Khachan, Joseph, Mendis, B. Upul Heyshan, Blackhall, Lachlan John Emblen
Year of Publication 31.10.2019
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Year of Publication 31.10.2019
Patent
Thruster
Blackhall Lachlan John Emblen, Mendis B. Upul Heyshan, Cartwright Iain, Li Weitang, Mehta Shyam, Wu Xioafeng, Khachan Joseph
Year of Publication 22.02.2018
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Year of Publication 22.02.2018
Patent
Thruster
Cartwright, Iain, Li, Weitang, Wu, Xioafeng, Mehta, Shyam, Khachan, Joseph, Mendis, B. Upul Heyshan, Blackhall, Lachlan John Emblen
Year of Publication 12.10.2017
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Year of Publication 12.10.2017
Patent