Claudio Zeni (@claudiozeni.bsky.social)

Using deep learning to increase the accuracy of computational chemistry and density functional theory Microsoft researchers achieved a breakthrough in the accuracy of DFT, a method for predicting the properties of molecules and materials, by using deep learning. This work can lead to better batteries,... https://microsoft.com/en-us/research/blog/breaking-bonds-breaking-ground-advancing-the-accuracy-of-computational-chemistry-with-deep-learning/