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Zhang, Zhao; Ren, Jiajun; Fang, Wei-Hai|One-shot simulation of static disorder in quantum dynamics with equilibrium initial state via matrix product state sampling,CHINESE JOURNAL OF CHEMICAL PHYSICS,2025,38(4):382-390
Liu, Meihui; Wang, Wei; Su, Peifeng; Ren, Jiajun; Peng, Qian|A Molecular Descriptor for Characterizing the Strength of Through-Space Conjugation for Luminescent Property in Organic Materials,JOURNAL OF PHYSICAL CHEMISTRY LETTERS,2025
Gu, Bing; Ren, Jiajun; Zhang, Junzhe|Quantum Chemistry Density Matrix Renormalization Group in the Discrete Variable Representation,JOURNAL OF CHEMICAL THEORY AND COMPUTATION,2025
Zhang, Zhao; Wang, Yijia; Zheng, Xiaoyan; Ren, Jiajun; Shuai, Zhigang; Fang, Weihai|Effect of Excitonic Coupling and Disorder on Nonradiative Decay of Molecular Aggregates: A TD-DMRG Study,JOURNAL OF PHYSICAL CHEMISTRY C,2025
Li, Jingjing; Li, Weitang; Xiao, Xiaoxiao; Liu, Limin; Li, Zhendong; Ren, Jiajun; Fang, Weihai|Multiset Variational Quantum Dynamics Algorithm for Simulating Nonadiabatic Dynamics on Quantum Computers,JOURNAL OF PHYSICAL CHEMISTRY LETTERS,2025
Wu, Baihua; Li, Bingqi; He, Xin; Cheng, Xiangsong; Ren, Jiajun; Liu, Jian|Nonadiabatic Field: A Conceptually Novel Approach for Nonadiabatic Quantum Molecular Dynamics,JOURNAL OF CHEMICAL THEORY AND COMPUTATION,2025
Guo, Wei; Song, Xiangmin; Gao, Yongchao; Yang, Shuai; Tang, Jiahong; Zhao, Chen; Wang, Haojing; Ren, Jiajun; Zeng, Lingda; Xu, Hanhong|Exploring Insecticidal Molecules with Random Forest: Toward High Insecticidal Activity and Low Bee Toxicity,JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,2025
Shuai, Zhigang; Sun, Qi; Ren, Jiajun; Jiang, Tong; Li, Weitang|Excited State Structure and Decay Rates for Aggregates,AGGREGATE,2025
Liu, Limin; Ren, Jiajun; Fang, Weihai|Improved memory truncation scheme for quasi-adiabatic propagator path integral via influence functional renormalization,JOURNAL OF CHEMICAL PHYSICS,2024,161(8)
Xu, Jingyi; Xue, Jie; Dai, Yu; Zhang, Jinyuan; Ren, Jiajun; Yao, Chengyu; Li, Shaman; Meng, Qingyu; Wen, Xueliang; Shao, Haoyun; Qiao, Juan|π-Bridge mediated coupling between inter- and intra-molecular charge transfer in aggregates for highly efficient near-infrared emission,AGGREGATE,2024

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