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Resource Metadata

hash 78535845859dfcd6deff31f6a314a494
metadata modified pirms 1 mēneša
method Density functional theory
mimetype application/vnd.openxmlformats-officedocument.spreadsheetml.sheet
modelling and simulation comments Migration barriers calculated with nudged elastic band method. Formation energies computed with the HSE06 hybrid functional.
size 22,4 KiB
software VASP

Pēdējo reizi mainīts 2025. gada 21. maijs
Izveidots 2025. gada 14. maijs
Formāts application/vnd.openxmlformats-officedocument.spreadsheetml.sheet
Licence Nav norādīta licence
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