Large-scale simulation of quantum computational chemistry on a new sunway supercomputer H Shang, L Shen, Y Fan, Z Xu, C Guo, J Liu, W Zhou, H Ma, R Lin, Y Yang, ...
SC22: International Conference for High Performance Computing, Networking …, 2022
33 2022 Q Chemistry: A quantum computation platform for quantum chemistry Y Fan, J Liu, X Zeng, Z Xu, H Shang, Z Li, J Yang
arXiv preprint arXiv:2208.10978, 2022
15 2022 Increasing the efficiency of massively parallel sparse matrix-matrix multiplication in first-principles calculation on the new-generation Sunway supercomputer X Chen, Y Gao, H Shang, F Li, Z Xu, X Liu, D Chen
IEEE Transactions on Parallel and Distributed Systems 33 (12), 4752-4766, 2022
8 2022 Differentiable matrix product states for simulating variational quantum computational chemistry C Guo, Y Fan, Z Xu, H Shang
Quantum 7, 1192, 2023
4 2023 MPS-VQE: A variational quantum computational chemistry simulator with matrix product states Z Xu, Y Fan, C Guo, H Shang
Computer Physics Communications 294, 108897, 2024
3 2024 Many-core acceleration of the first-principles all-electron quantum perturbation calculations H Shang, X Duan, F Li, L Zhang, Z Xu, K Liu, H Luo, Y Ji, W Zhao, W Xue, ...
Computer Physics Communications 267, 108045, 2021
3 2021 Scalable and Differentiable Simulator for Quantum Computational Chemistry Z Xu, H Shang, Y Fan, X Zeng, Y Zhang, C Guo
2024 IEEE International Parallel and Distributed Processing Symposium (IPDPS …, 2024
2024