Leverhulme Research Centre for Functional Materials Design
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ICSDClient
ICSDClient PublicA 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.
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FUSE-stable
FUSE-stable PublicThe latest stable release for the crystal structure prediction code FUSE
Repositories
- AriadneX Public
Unknown Crystalline Phase Discovery from Anomaly-aware Unmixing of Powder X-Ray Diffraction Patterns
- ElM2D Public
A high performance mapping class to construct ElM2D plots from large datasets of inorganic compositions.
- ElMTree Public
An implementation of the list of clusters data structure in python to index materials datasets with respect to the Element Movers Distance for fast similarity searches. This includes a simple Flask application for hosting a live interface
- thermal_conductivity_RF Public
- pigen Public
- PhaseFieldRanking Public
Unsupervised ranking of the elemental combinations (phase fields) by similarity with the patterns learnt from ICSD
- LMDS_MOF_Synthesizability Public Forked from lrcfmd/LMDS_MOF_Porosity_Tool
A github containing the code for the MOF synthesizability prediction tool
- LMDS_heat_capacity_modelling Public
A git repository for the heat capacity modelling app on the LMDS
- LiIonMLWebApp Public
A Flask WebApp demonstrating the code used in the Liverpool Materials Discovery Server
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