Lv5
1240 积分 2023-07-04 加入
Deep-learning electronic structure calculations
12小时前
求助中
A universal graph deep learning interatomic potential for the periodic table
26天前
已完结
Modeling the impact of structure and coverage on the reactivity of realistic heterogeneous catalysts
1个月前
已完结
Flow matching for accelerated simulation of atomic transport in crystalline materials
1个月前
已完结
Accelerating the calculation of electron–phonon coupling strength with machine learning
2个月前
已完结
Generating Minimal Training Sets for Machine Learned Potentials
2个月前
已完结
Unraveling the Atomic‐scale Mechanism of Phase Transformations and Structural Evolutions during (de)Lithiation in Si Anodes
4个月前
已完结
Understanding solid-state battery electrolytes using atomistic modelling and machine learning
4个月前
已完结
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