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Atomistics Course

Atomistics Course
from 4 to 360h flexible workload
valid certificate in your country

What will I learn?

Dis Atomistics Course gi yuh a practical toolkit fi model Li conductors from crystal structure right dung to transport properties. Yuh guh learn how fi build supercells, bring in defects an dopants, pick DFT or MD methods, an set strong simulation parameters. Yuh guh analyze diffusion pathways, conductivities, an structure-property relations, fi mek faster, more reliable design a high-performance solid-state materials.

Elevify advantages

Develop skills

  • Build atomistic Li conductor models: unit cells, supercells, an defects.
  • Run an tune MD simulations: ensembles, thermostats, barostats, an timesteps.
  • Analyze Li diffusion: MSD, van Hove, Arrhenius fits, an ionic conductivity.
  • Extract structure-property trends: bottlenecks, migration barriers, an dopants.
  • Use VESTA, VMD, OVITO, an pymatgen fi automate visualization an data analysis.

Suggested summary

Before starting, you can change the chapters and the workload. Choose which chapter to start with. Add or remove chapters. Increase or decrease the course workload.
Workload: between 4 and 360 hours

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