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QE-to-TCAD

Pipeline automatisé Quantum ESPRESSO → TCAD

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Full automation

From crystal structure (Materials Project) to QE files, SCF/NSCF/epsilon calculations and JSON export — without manual intervention.

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Dielectric extraction

Static dielectric constant ε₀, plasma frequencies ω_p and full ε(ω) dispersion, ready for device engineering.

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Native TCAD export

Structured JSON compatible with Sentaurus, Silvaco and DEVSIM workflows for 1D device validation.