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soft:siman

Siman Wiki

About

Citation

Aksyonov et. al, Understanding migration barriers for monovalent ion insertion in transition metal oxide and phosphate based cathode materials: A DFT study, Comp. Mat. Sci. 154, 449-458, 2018

Tutorials

General

Geometrical

Advanced calculations

Specific for Li-ion cathode materials

Additional control of Siman

Drafts

Currently relevant only for Skoltech users

File examples

Example of project_sets.py with sets used for calculation of cathode materials

Example of interfaces.py

For developers

soft/siman.txt · Last modified: 2023/06/16 17:20 by a.boev

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