Efficient modeling of dynamic properties in K₃C₆₀ using machine learning forc...

Fullerides forms a big familiy of molecular crystals exhibiting various useful electro- and magnetochemical properties. Therefore, an efficient in silico method is desirable to...富勒化物（Fullerides）是一类庞大的分子晶体家族，展现出多种兼具实用价值的电化学与磁化学特性。因此，亟需一种高效的计算机模拟（in silico）方法以用于……