A unified heterogeneous implementation of numerical atomic orbitals-based real-time TDDFT within the ABACUS package - Taoni Bao; Yuanbo Li; Zichao Deng; Haotian Zhao; Denghui Lu; Yike Huang; Chao Lian; Lixin He; Mohan Chen (Computer Physics Communications, 2026)

Spatio-temporal neural operator on complex geometries - Xiaoyang Fu; Gengxiang Chen; Yingguang Li; Xu Liu; Lu Chen; Qinglu Meng; Changqing Liu; Xiaozhong Hao (Computer Physics Communications, 2025)

A method for optimizing different geometric shields of D-T neutron generators by combining BP neural network and Analytic Hierarchy Process - Jiayu Li; Shiwei Jing; Jingfei Cai; Hailong Xu; Pingwei Sun; Yingying Cao; Shangrui Jiang; Shaolei Jia; Zhaohu Lu; Guanghao Li (Computer Physics Communications, 2025)