LDOS/SNAP data for MALA: Aluminium at 298K and 933K

# Aluminium data set for Machine Learning applications This dataset contains DFT inputs, outputs, LDOS data and bispectrum descriptor vectors for an aluminium cell of 256 atoms...# 面向机器学习应用的铝数据集 本数据集包含256原子铝晶胞的密度泛函理论（DFT, Density Functional Theory）输入数据、输出数据、局域态密度（LDOS, Local Density of States）数据以及双谱描述符向量。