论文标题
机器学习和密度功能理论
Machine learning and density functional theory
论文作者
论文摘要
在过去的十年中,机器学习在近似密度功能方面取得了重大进步,但是这是否标志着人类设计的功能的终结还有待观察。 Ryan Pederson,Bhupalee Kalita和Kieron Burke讨论了用于功能设计的机器学习的兴起。
Over the past decade machine learning has made significant advances in approximating density functionals, but whether this signals the end of human-designed functionals remains to be seen. Ryan Pederson, Bhupalee Kalita and Kieron Burke discuss the rise of machine learning for functional design.