Efficient prediction for high precision CO-N2 potential energy surface by stacking ensemble DNN.
Shanshan XuYou LiDonghan WangChao FangChengwei LuoJiankun DengLiHong HuHui LiHongzhi LiPublished in: J. Comput. Chem. (2022)
Keyphrases
- high precision
- high recall
- high reliability
- ensemble learning
- neural network
- achieve high precision
- three dimensional
- cost effective
- prediction model
- ensemble methods
- base classifiers
- prediction accuracy
- energy minimization
- surface reconstruction
- prediction error
- precision and recall
- ensemble classifier
- benchmark datasets
- neural network ensemble