摘要
由一名新闻记者兼机器人与机器学习的工作人员新闻编辑每日新闻-一项关于机器学习的新研究现在已经可用。根据来自中国昆明的新闻报道,NewsRx记者称,"我们提出了一种新的焦油驱动方法,旨在利用全面的C2DB数据库E预测二维(2D)材料的Heyd-Scuseria-Ernzerhof(HSE)带隙。这种创新方法结合机器学习和密度泛函理论(DFT)计算来预测HSE带隙,导带最小值(C BM)。2176种二维材料的价带最大值为(VBM)。
Abstract
By a News Reporter-Staff News Editor at Robotics & Machine Learning Daily News Daily News – A new study on Machine Learning is now available. According to news reporting originating from Kunming, People’s Repub lic of China, by NewsRx correspondents, research stated, “We present a novel tar get-driven methodology devised to predict the Heyd-Scuseria-Ernzerhof (HSE) band gap of two-dimensional (2D) materials leveraging the comprehensive C2DB databas e. This innovative approach integrates machine learning and density functional t heory (DFT) calculations to predict the HSE band gap, conduction band minimum (C BM), and valence band maximum (VBM) of 2176 types of 2D materials.”