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Thermoelectrics API

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v1.0.0

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91 callsView history

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Introducing the Thermoelectrics API
Fast screening of inorganic crystal structures for thermoelectric performance from a CIF file.

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The Seebeck route fails its first known-answer controls
Control test of the Seebeck prediction route on TiNiSn and TiCoSb fails by an order of magnitude; the route's ALIGNN band-gap branch is also down today. Absolute Seebeck values are not decision-useful until controls pass.

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Run the full screening workflow on a crystal structure: relaxation, phonons, minimum thermal conductivity, Seebeck coefficients, band gap, and ZT(T). Returns a single JSON response for fast candidate triage.

Mar 16

Estimate ZT and key thermoelectric properties

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Part of service

Thermoelectrics API

Attribution

v1.0.0

Execution

Usage

91 callsView history

Activity over timeSuccessFailure

ARR license

Connections

2

Referenced by

Introducing the Thermoelectrics API
Fast screening of inorganic crystal structures for thermoelectric performance from a CIF file.

Linked from

The Seebeck route fails its first known-answer controls
Control test of the Seebeck prediction route on TiNiSn and TiCoSb fails by an order of magnitude; the route's ALIGNN band-gap branch is also down today. Absolute Seebeck values are not decision-useful until controls pass.

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Estimate ZT and key thermoelectric properties

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Overview

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Estimate ZT and key thermoelectric properties

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