Neural

【论文阅读】ANI-1:an extensible neural network potential with DFT accuracy at force field computational co

文章目录前言一、模型架构二、嵌入1.原子类型区分2.角度函数修正前言书接上文： 【论文阅读】Generalized Neural-Network Representation of High-Dimensio

论文 Neural Network extensible potential

admin 2月前

6 0
【论文阅读】Generalized Neural-Network Representation of High-Dimensional Potential-Energy Surfaces

【论文阅读】Generalized Neural-Network Representation of High-Dimensional Potential-Energy Surfaces 一.背景二.嵌入1.径向部分高斯函数截断函数 2.角

论文 Neural Network Representation Generalized

admin 2月前

5 0