Update: 2024.03.28
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π Trending Up
Projects that have a higher project-quality score compared to the last update. There might be a variety of reasons, such as increased downloads or code activity.
- ABACUS (π₯23 Β· β 140 Β· π) - An electronic structure package based on either plane wave basis or numerical atomic orbitals.
LGPL-3.0 - dargs (π₯17 Β· β 5 Β· π) - Argument processing for the deep modeling project.
LGPL-3.0 - rid-kit (π₯13 Β· β 42 Β· π) - Reinforced dynamics.
LGPL-3.0 - APEX (π₯12 Β· β 13 Β· π) - APEX: Alloy Properties EXplorer using simulations.
LGPL-3.0 - DeePKS-kit (π₯10 Β· β 97 Β· π€) - a package for developing machine learning-based chemically accurate energy and density functional models.
LGPL-3.0
π Trending Down
Projects that have a lower project-quality score compared to the last update. There might be a variety of reasons such as decreased downloads or code activity.
- DeePMD-kit (π₯28 Β· β 1.3K Β· π) - A deep learning package for many-body potential energy representation and molecular dynamics.
LGPL-3.0 - DP-GEN (π₯22 Β· β 270 Β· π) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.
LGPL-3.0 - reacnetgenerator (π₯20 Β· β 57 Β· π) - an automatic reaction network generator for reactive molecular dynamics simulation.
LGPL-3.0 - DeepFlame (π₯16 Β· β 120 Β· π) - A deep learning empowered open-source platform for reacting flow simulations.
GPL-3.0