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Thermal Conductivity (1 sub-skills: lattice-thermal-conductivity)
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Based on SOC occupation classification
| name | thermoconductivity |
| description | Thermal Conductivity (1 sub-skills: lattice-thermal-conductivity) |
| Skill | Path | Description |
|---|---|---|
| Lattice Thermal Conductivity | lattice-thermal-conductivity/ | Compute lattice thermal conductivity via phono3py (BTE), Green-Kubo MD, or QE+phono3py. Covers 2nd/3rd order force constants, linearized Boltzmann transport equation, and heat-flux autocorrelation methods. |
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