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Run the full workflow on a crystal structure: relaxation, phonons, lattice thermal conductivity, DFT band gap, BoltzTraP2 Seebeck at fixed doping, and ZT_max(T). Use quality=screening (default) for triage and quality=converged for final numbers.
Pricing
USDYou pay for the seconds a run takes. The most it can cost is held while it runs and the rest is returned. Failed runs are free.
Median and 95th percentile of the last 7 successful runs.
Execution
Usage
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