sivonxay

sivonxay's Stars

• JuDFTteam/best-of-atomistic-machine-learning

  🏆 A ranked list of awesome atomistic machine learning projects ⚛️🧬💎.

  27521

• txie-93/cdvae

  An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]

  Language:Python21688

• dair-ai/ml-visuals

  🎨 ML Visuals contains figures and templates which you can reuse and customize to improve your scientific writing.

  12.9k1.4k

• BlauGroup/RNMC

  Language:C++167

• BlauGroup/NanoParticleTools

  Language:Python75

• ACEsuit/mace

  MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.

  Language:Python437170

• Detergent13/tft-bot

  Automate Teamfight Tactics (TFT) for token/mission farming. Updated for Set 11!

  Language:Python8245

• WMD-group/MacroDensity

  Python package to analyse electron density & electrostatic potential grids

  Language:Python8244

• WMD-group/GQCA_alloys

  Code to analyse thermodynamics of alloys through the generalized quasi-chemical approximation (GQCA)

  Language:Python138

• materialsproject/mpmorph

  MPmorph is a collection of tools to run and analyze ab-initio molecular dynamics (AIMD) calculations run with VASP, and is currently under development. It relies heavily on tools developed by the Materials Project (pymatgen, custodian, fireworks) and atomate.

  Language:Python6231