Do we really need machine learning interatomic potentials for modeling amorph...

In this study, we benchmarked various interatomic potentials and force fields in comparison to an ab initio dataset for bulk amorphous alumina. We investigated a comprehensive...本研究中，我们以块状非晶氧化铝（bulk amorphous alumina）的从头算（ab initio）数据集为参照，对多种原子间势（interatomic potentials）与力场（force fields）开展了基准测试。本研究还对一套全面的……