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Journal of Chemical Theory and Computation|September 7, 2016
Inner Space Perturbation Theory in Matrix Product States: Replacing Expensive Iterative DiagonalizationJiajun Ren, Yuanping Yi, Zhigang Shuai
The Journal of Physical Chemistry Letters|May 2, 2017
Role of the Dark 2Ag State in Donor-Acceptor Copolymers as a Pathway for Singlet Fission: A DMRG StudyJiajun Ren, Qian Peng, Xu Zhang, et al.
Journal of Computational Chemistry|March 1, 2008
Local approach to coupled cluster evaluation of polarizabilities for long conjugated moleculesQingxu Li, Yuanping Yi, Zhigang Shuai
The Journal of Chemical Physics|November 10, 2006
The correction vector method for three-photon absorption: the effects of pi conjugation in extended rylenebis(dicarboximide)sYuanping Yi, Lingyun Zhu, Zhigang Shuai
The Journal of Chemical Physics|January 17, 2020
Numerical assessment for accuracy and GPU acceleration of TD-DMRG time evolution schemesWeitang Li, Jiajun Ren, Zhigang Shuai
The Journal of Physical Chemistry Letters|September 22, 2021
Chebyshev Matrix Product States with Canonical Orthogonalization for Spectral Functions of Many-Body SystemsTong Jiang, Jiajun Ren, Zhigang Shuai
The Journal of Physical Chemistry Letters|June 4, 2020
Finite-Temperature TD-DMRG for the Carrier Mobility of Organic SemiconductorsWeitang Li, Jiajun Ren, Zhigang Shuai
Nature Communications|August 19, 2023
Minimizing non-radiative decay in molecular aggregates through control of excitonic couplingYuanheng Wang, Jiajun Ren, Zhigang Shuai
Nature Communications|July 13, 2021
A general charge transport picture for organic semiconductors with nonlocal electron-phonon couplingsWeitang Li, Jiajun Ren, Zhigang Shuai
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