Skip to content
@lrcfmd

Leverhulme Research Centre for Functional Materials Design

Code hosted here has been developed by researchers working with the LRC, hosted at the University of Liverpool

Popular repositories Loading

  1. ipcsp ipcsp Public

    Integer Programming encoding for Crystal Structure Prediction with classic and quantum computing bindings

    Python 48 15

  2. ElMD ElMD Public

    The Element Movers Distance for chemical composition similarity

    Python 33 9

  3. ChemDASH ChemDASH Public

    Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments

    Python 22 9

  4. LiIonML LiIonML Public

    A collection of notebooks in support of the publication "A Database of Experimentally Measured Lithium Solid Electrolyte Conductivities Evaluated with Machine Learning"

    Jupyter Notebook 20 4

  5. ICSDClient ICSDClient Public

    A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/index.xhtml for further details.

    Python 17 8

  6. FUSE-stable FUSE-stable Public

    The latest stable release for the crystal structure prediction code FUSE

    Python 12 2

Repositories

Showing 10 of 42 repositories
  • Site-Net-DeepInfoMax Public

    Implementation of the Deep InfoMax self-supervised learning methodology on top of Site-Net

    lrcfmd/Site-Net-DeepInfoMax’s past year of commit activity
    Jupyter Notebook 0 0 0 0 Updated Mar 23, 2025
  • ElMD Public

    The Element Movers Distance for chemical composition similarity

    lrcfmd/ElMD’s past year of commit activity
    Python 33 GPL-3.0 9 0 0 Updated Mar 21, 2025
  • kagome_database Public
    lrcfmd/kagome_database’s past year of commit activity
    Jupyter Notebook 1 0 0 0 Updated Mar 19, 2025
  • FUSE-stable Public

    The latest stable release for the crystal structure prediction code FUSE

    lrcfmd/FUSE-stable’s past year of commit activity
    Python 12 GPL-3.0 2 0 0 Updated Jan 29, 2025
  • LEAF Public

    Local Environment-based Atomic Features

    lrcfmd/LEAF’s past year of commit activity
    Python 11 MIT 1 0 0 Updated Dec 19, 2024
  • ICSDClient Public

    A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/index.xhtml for further details.

    lrcfmd/ICSDClient’s past year of commit activity
    Python 17 GPL-3.0 8 1 1 Updated Nov 20, 2024
  • lpoolmat_llms Public Forked from fedeotto/lpoolmat_llms
    lrcfmd/lpoolmat_llms’s past year of commit activity
    Jupyter Notebook 0 2 0 0 Updated Aug 19, 2024
  • veltiCRYS Public
    lrcfmd/veltiCRYS’s past year of commit activity
    Python 5 GPL-3.0 1 0 0 Updated Jul 17, 2024
  • HyperConvexHull Public

    Computed Phase Diagrams for hyper-dimensional convex hull with Materials Project references

    lrcfmd/HyperConvexHull’s past year of commit activity
    Python 0 0 0 0 Updated Jun 24, 2024
  • MPDS_API Public

    Scripts for MPDS API

    lrcfmd/MPDS_API’s past year of commit activity
    Python 0 0 0 0 Updated Jun 24, 2024
View all repositories

People

This organization has no public members. You must be a member to see who’s a part of this organization.

Top languages

Loading…

Most used topics

Loading…