MISA-AKMC : Achieve Kinetic Monte Carlo Simulation of 20 Quadrillion Atoms on GPU Clusters.

Xinfu He Shunde Li Zhijie Pan Ningming Nie Jue Wang 0013 He Bai 0005 Genshen Chu Yan Zeng Xinfu He Yangang Wang 0002 Changjun Hu Xuebin Chi MISA-AKMC : Achieve Kinetic Monte Carlo Simulation of 20 Quadrillion Atoms on GPU Clusters. 1661-1675 2025 SC https://doi.org/10.1145/3712285.3759781 conf/sc/2025 db/conf/sc/sc2025.html#LiPNW0CZHWHC25

Qi Li 0039 Kun Li 0016 Haozhi Han Honghui Shang Xinfu He Yunquan Zhang Hong An Ting Cao 0003 Mao Yang 0004 SwarmThinkers: Learning Physically Consistent Atomic KMC Transitions at Scale. 2025 May abs/2505.20094 CoRR https://doi.org/10.48550/arXiv.2505.20094 db/journals/corr/corr2505.html#abs-2505-20094 streams/journals/corr

Jianjiang Li Jiali Li Yun Yang Baixue Ji Dandan Chen Xinfu He Ningming Nie A parallel ETD algorithm for large-scale rate theory simulation. 14215-14230 2022 78 J. Supercomput. 12 https://doi.org/10.1007/s11227-022-04434-2 db/journals/tjs/tjs78.html#LiLYJCHN22

Zongguo Wang Ziyi Chen Xinfu He Han Cao Yuedong Cui Meng Wan Jue Wang 0013 Yangang Wang 0002 Data-Driven Approach for Investigation of Irradiation Hardening Behavior of RAFM Steel. 117-127 2022 KSEM (2) https://doi.org/10.1007/978-3-031-10986-7_10 conf/ksem/2022-2 db/conf/ksem/ksem2022-2.html#WangCHCCWWW22

Genshen Chu Yang Li Runchu Zhao Shuai Ren Wen Yang Xinfu He Changjun Hu Jue Wang MD simulation of hundred-billion-metal-atom cascade collision on Sunway Taihulight. 108128 2021 269 Comput. Phys. Commun. https://doi.org/10.1016/j.cpc.2021.108128 db/journals/cphysics/cphysics269.html#ChuLZRYHHW21

Dandan Chen Xinfu He Genshen Chu Xiao He Lixia Jia Zhaoshun Wang Wen Yang Changjun Hu An overview: multiscale simulation in understanding the radiation damage accumulation of reactor materials. 2021 97 Simul. 10 https://doi.org/10.1177/0037549719880940 https://www.wikidata.org/entity/Q127072431 db/journals/simulation/simulation97.html#ChenHCHJWYH21

Genshen Chu Yang Li Runchu Zhao Shuai Ren Wen Yang Xinfu He Chungjun Hu Jue Wang MD Simulation of Hundred-Billion-Metal-Atom Cascade Collision on Sunway Taihulight. 2021 abs/2107.07866 CoRR https://arxiv.org/abs/2107.07866 db/journals/corr/corr2107.html#abs-2107-07866

Jue Wang Xinfu He Special issue on advanced simulation in engineering. 2020 34 Int. J. High Perform. Comput. Appl. 2 https://doi.org/10.1177/1094342020905932 db/journals/ijhpca/ijhpca34.html#WangH20

Mincong Luo Xinfu He Li Liu Generative Model for Material Experiments Based on Prior Knowledge and Attention Mechanism. 2018 abs/1811.07982 CoRR http://arxiv.org/abs/1811.07982 db/journals/corr/corr1811.html#abs-1811-07982

Changjun Hu Xianmeng Wang Jianjiang Li Xinfu He Shigang Li 0002 Yangde Feng Shaofeng Yang He Bai 0005 Kernel optimization for short-range molecular dynamics. 31-40 2017 211 Comput. Phys. Commun. https://doi.org/10.1016/j.cpc.2016.07.010 db/journals/cphysics/cphysics211.html#HuWLHLFYB17

Changjun Hu He Bai 0005 Xinfu He Boyao Zhang Ningming Nie Xianmeng Wang Yingwen Ren Crystal MD: The massively parallel molecular dynamics software for metal with BCC structure. 73-78 2017 211 Comput. Phys. Commun. https://doi.org/10.1016/j.cpc.2016.07.011 db/journals/cphysics/cphysics211.html#HuBHZNWR17

Hong An He Bai 0005 Han Cao Ting Cao 0003 Dandan Chen Ziyi Chen Xuebin Chi Genshen Chu Yuedong Cui Yangde Feng Haozhi Han Xiao He Changjun Hu Chungjun Hu Baixue Ji Lixia Jia Jiali Li Jianjiang Li Kun Li 0016 Qi Li 0039 Shigang Li 0002 Shunde Li Yang Li Li Liu Mincong Luo Ningming Nie Zhijie Pan Shuai Ren Yingwen Ren Honghui Shang Meng Wan Jue Wang Jue Wang 0013 Xianmeng Wang Yangang Wang 0002 Zhaoshun Wang Zongguo Wang Mao Yang 0004 Shaofeng Yang Wen Yang Yun Yang Yan Zeng Boyao Zhang Yunquan Zhang Runchu Zhao