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Recent implementations in kylin 1.3: Improved computational efficiency of ab initio DMRG and a spin-adapted version of EC-MRCI 期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2025, 卷号: 38, 期号: 4, 页码: 447-456
作者:  Song, Yinxuan;  Tian, Yingqi;  Cheng, Yifan;  Ma, Haibo
收藏  |  浏览/下载:3/0  |  提交时间:2025/12/03
Quantum chemistry program  Density matrix renormalization group  Strong correlation  Multi-reference  
Bridging the Gap between Transformer-Based Neural Networks and Tensor Networks for Quantum Chemistry 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2025, 页码: 14
作者:  Kan, Bowen;  Tian, Yingqi;  Wu, Yangjun;  Zhang, Yunquan;  Shang, Honghui
收藏  |  浏览/下载:13/0  |  提交时间:2025/06/25
Solving the Electronic Schr?dinger Equation by Pairing Tensor-Network State with Neural Network Quantum State 期刊论文
MATHEMATICS, 2024, 卷号: 12, 期号: 3, 页码: 16
作者:  Kan, Bowen;  Tian, Yingqi;  Xie, Daiyou;  Wu, Yangjun;  Fan, Yi;  Shang, Honghui
收藏  |  浏览/下载:42/0  |  提交时间:2024/05/20
quantum mechanics  neural network quantum state  high-performance simulations  strongly correlated materials  81-10