The tensor-network message-passing method reduces the error in the calculation of local observables by several orders of magnitude compared with state-of-the-art techniques go.aps.org/3IYvItD

Study on the electronic properties and superconductivity of bilayer La3Ni2O7 cpl.iphy.ac.cn/10.1088/0256-3…

Sasha Rush here is my taxonomy of these methods and some works till 2021 I was tracking

Introducing #XtalNet by Guolin Ke and team: E2E crystal structure prediction from PXRD data with contrastive learning and #diffusion based conditional crystal structure generation. paper: arxiv.org/abs/2401.03862 dataset：drive.google.com/drive/folders/… #AI4Sci #GenAI #Crystallography

Thrilled to officially be a part of Team W1LD and introduce my new signature off-string yo-yo, "Boundless"!

Goodfellow talking about controlling a Tokamak with RL at Mila.

“autoregressive” versus “transportation”would be the right way to contrast

Google 翻译 😅中译英——英译中后的效果

I guess the “rule of four” is a result of: 1) the distribution of materials among space groups; 2) the distribution of atoms in Wyckoff positions; 3) the multiplicities of Wyckoff positions. 1) and 2) are determined by inter-atomic interactions while 3) is fixed by group theory.

Penzai’s Colab integration is just 🤯

I think this is based on an unfair comparison of "filtering out invalid SMILES" versus "retaining all SELFIES". Filtering out invalid SMILES improves the model's performance because they have low likelihoods. In fact, one can also filter out SELFIES with low likelihoods.

We have a few spots left! Register now at indico.hiskp.uni-bonn.de/event/443/ 14 technical talks 3 keynotes 3 panel discussions 1 poster session and much more... Including speakers like (in random order) pan tom, Jonas Köhler, Michael Albergo, Lei Wang, Lorenz Richter, and many more!

Normal and Superconducting Properties of La3Ni2O7 #Physics #Science Read more iopscience.iop.org/article/10.108…