Kavli Affiliate: Ke Wang | First 5 Authors: Hao-Cheng Thong, XiaoYang Wang, Han Wang, Linfeng Zhang, Ke Wang | Summary: Ferroelectric perovskites have been ubiquitously applied in piezoelectric devices for decades, among which, eco-friendly lead-free (K,Na)NbO3-based materials have been recently demonstrated to be an excellent candidate for sustainable development. Molecular dynamics is a versatile theoretical […]
Continue.. Machine-learning interatomic potential for molecular dynamics simulation of ferroelectric KNbO3 perovskite