Laboratory for Materials Simulations (PSI)
- 8 followers
- Switzerland
- https://www.psi.ch/en/lms
Popular repositories Loading
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tool-layer-raman-ir
tool-layer-raman-ir PublicA tool to compute and visualize Raman-active and Infrared-active modes in layered materials
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tool-ml-layer-finder
tool-ml-layer-finder PublicTool to find layers (and low-dimensional structures) within a bulk 3D structure, combined with machine learning to predict if the layer has a low binding energy
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Repositories
- aiida-hydrogen-restorer Public
Workflows to detect missing hydrogens in crystal structures from external databases and use DFT simulations to restore them in the correct positions
- tool-ml-layer-finder Public
Tool to find layers (and low-dimensional structures) within a bulk 3D structure, combined with machine learning to predict if the layer has a low binding energy
- lowdimfinder Public
- tool-layer-raman-ir Public
A tool to compute and visualize Raman-active and Infrared-active modes in layered materials
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