DeePMD-kit v3: A Multiple-Backend Framework for Machine Learning Potentials
DeePMD-kit v3：面向机器学习潜力的多后端框架
期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.5c00340
Zeng, Jinzhe; Zhang, Duo; Peng, Anyang; Zhang, Xiangyu; He, Sensen; Wang, Yan; Liu, Xinzijian; Bi, Hangrui; Li, Yifan; Cai, Chun; Zhang, Chengqian; Du, Yiming; Zhu, Jia-Xin; Mo, Pinghui; Huang, Zhengtao; Zeng, Qiyu; Shi, Shaochen; Qin, Xuejian; Yu, Zhaoxi; Luo, Chenxing; Ding, Ye; Liu, Yun-Pei; Shi, Ruosong; Wang, Zhenyu; Bore, Sigbjørn Løland; Chang, Junhan; Deng, Zhe; Ding, Zhaohan; Han, Siyuan; Jiang, Wanrun; Ke, Guolin; Liu, Zhaoqing; Lu, Denghui; Muraoka, Koki; Oliaei, Hananeh; Singh, Anurag Kumar; Que, Haohui; Xu, Weihong; Xu, Zhangmancang; Zhuang, Yong-Bin; Dai, Jiayu; Giese, Timothy J; Jia, Weile; Xu, Ben; York, Darrin M; Zhang, Linfeng; Wang, Han
