AIQM1 (artificial intelligence–quantum mechanical method 1)

New example on the application of XACS showcases the study of Wang Changwei from Shaanxi Normal University and Mo Yirong from the University of North Carolina at Greensboro.

MLatom@XACS is a powerful tool for training and using machine learning potentials. It supports a wide variety of representative potentials.

We will hold online broadcast demonstrating new features on April 3, at 15:30 Beijing time/9:30 am CET on the XACS Youtube channel.

Prof. Su's group has recently developed the GKS-EDA(TD) method, which is based on GKS-EDA, for quantitatively investigating the nature of intermolecular interactions in excited states.