@te_materials

This account was created to share thermoelectricity-related content

tinyurl.com/ateguide
Joined January 2023
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Ultra-Low Thermal Conductivity in Mixed Anionic CuTe2Cl: Strong Antibonding States and Lone Pair-Induced Te Ring Puckering doi.org/10.1002/anie.2538518

Ultra‐Low Thermal Conductivity in Mixed Anionic CuTe2Cl: Strong Antibonding States and Lone...

Strong Cu 3d-Te 5p and Cu 3d-Cl 3p antibonding interactions induce lattice softening, and Te 5s2 lone-pair-driven ring puckering enhances lattice anharmonicity, markedly suppressing heat-carrying...

onlinelibrary.wiley.com
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Realizing High Thermoelectric Performance in n-Type Cubic GeSe via AgBiTe2 Alloying doi.org/10.34133/energymatad…

Realizing High Thermoelectric Performance in n-Type Cubic GeSe via AgBiTe2 Alloying | Energy...

spj.science.org
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High thermoelectric performance in n-type–cubic (SnSe)0.55(PbTe)0.45 polycrystals via suppressed ionized impurity scattering doi.org/10.1016/j.actamat.20…
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Ultrafast Solid-State Synthesis of Chevrel Phases for Microstructure-Enabled Thermoelectric Transport Optimization doi.org/10.1002/smll.76143

Ultrafast Solid‐State Synthesis of Chevrel Phases for Microstructure‐Enabled Thermoelectric...

An ultrafast 20-minute solid-state synthesis yields phase-pure ternary Chevrel phases while limiting grain coarsening, providing a route to microstructure-controlled thermoelectric transport....

onlinelibrary.wiley.com
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Filling faults and vacancy swap occupation in half-Heusler compounds doi.org/10.1093/nsr/nwag458

Filling faults and vacancy swap occupation in half-Heusler compounds

A newly discovered planar defect, the filling fault, in HH compounds resolves long-standing atomic-occupation puzzles and strongly enhances piezoelectricit

academic.oup.com
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Amorphous Nanodomains Enable High Device-Level Cooling Performance in Crack-Free Hot-Extruded n-Type Bi2Te3 Thermoelectrics doi.org/10.1021/acsami.6c080…

Amorphous Nanodomains Enable High Device-Level Cooling Performance in Crack-Free Hot-Extruded...

AbstractPremature cracking during free hot deformation (FHD) of n-type Bi2Te2.7Se0.3 limits the attainable strain, thereby interrupting dynamic recrystalli

pubs.acs.org
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Crystal Structure Prediction of Inorganic Materials: A Benchmark and Modern Evaluation doi.org/10.1002/aidi.70162

Crystal Structure Prediction of Inorganic Materials: A Benchmark and Modern Evaluation

Predicting a crystal’s structure from composition alone is a long-standing challenge in materials discovery. The CSP180 benchmark of 180 inorganic crystals evaluates thirteen crystal structure...

advanced.onlinelibrary.wiley.com
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Thermoelectric conversion module using type-II (K,Ba)24(Ga,Sn)136 and segmented type-VIIIBa8Ga16(Sn,Ge)30/type-I Ba8Ga16Ge30 clathrates doi.org/10.35848/1347-4065/a…

Thermoelectric conversion module using type-II (K,Ba) (Ga,Sn) and segmented type-VIII Ba Ga (Sn,Ge)...

Thermoelectric conversion module using type-II (K,Ba) 24 (Ga,Sn) 136 and segmented type-VIII Ba 8 Ga 16 (Sn,Ge) 30 /type-I Ba 8 Ga 16 Ge 30 clathrates, Kishimoto, Kengo, Nagai, Shun, Akai, Koji

iopscience.iop.org
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Enhanced Near-Room-Temperature Thermoelectric Properties in Yb-Doped Off-Stoichiometry α-Cu2+xSe doi.org/10.1021/acsaelm.6c00…

Enhanced Near-Room-Temperature Thermoelectric Properties in Yb-Doped Off-Stoichiometry α-Cu2+xSe

AbstractCu2Se is a well-known high zT thermoelectric (TE) material, but at room temperature it has poor TE properties due to its excessive carrier concentr

pubs.acs.org
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Phase Boundary Engineering Enables Multivalley Activation for High-Performance ZrCoSb Half-Heuslers doi.org/10.1021/jacs.6c12433

Phase Boundary Engineering Enables Multivalley Activation for High-Performance ZrCoSb Half-Heuslers

Abstract. P-type ZrCoSb-based half-Heusler compounds are promising thermoelectric materials for high-temperature power generation because of their excellen

pubs.acs.org
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Co-doping enables band convergence, dopability preservation and dislocation engineering in PbTe thermoelectrics Eu/Mg/Na co-doping combines band convergence, carrier optimization and dislocation scattering to push zT above 2.7. sciengine.com/SCMs/doi/10.10… #Thermoelectrics
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Local-distortion regulation of small-polaron transport: A design degree of freedom for thermoelectric oxides doi.org/10.1002/inf2.70190

Local‐distortion regulation of small‐polaron transport: A design degree of freedom for thermoelec...

The thermoelectric performance of oxides is closely linked to how small polarons move through a locally distorted crystal lattice. Here, we compare Ce- and La-doped CaMnO3 with comparable carrier...

onlinelibrary.wiley.com
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Magnetic Weyl Semi-Metallicity and Berry Curvature-Driven Transport Signatures in CoYCrAl Quaternary Heusler Compound doi.org/10.1002/adts.70567

Magnetic Weyl Semi‐Metallicity and Berry Curvature‐Driven Transport Signatures in CoYCrAl Quatern...

An ab initio prediction of a new magnetic Heusler compound, stable in the LiMgPdSn-type structure having F4¯3m space group, exhibiting Weyl fermionic states, pronounced Berry-curvature effects,...

advanced.onlinelibrary.wiley.com
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Why Band Convergence Benefits Thermoelectrics: The Role of Δk and Effective Mass in Intervalley Scattering doi.org/10.21203/rs.3.rs-110…
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Physics-Grounded Materials Artificial Intelligence for Reliable Materials Discovery doi.org/10.1002/adfm.78119

Physics‐Grounded Materials Artificial Intelligence for Reliable Materials Discovery

Physics-Grounded Materials AI (PhysMat AI) integrates physical priors, descriptors, constraints, verification, and data infrastructure into a unified full-stack framework, enabling reliable, interp...

advanced.onlinelibrary.wiley.com
Tohoku University@TohokuUniPRSep 29
A new perspective paper published by Tohoku University researchers developed a framework for incorporating physics-based principles into AI to generate more interpretable, testable, and meaningful predictions. #TohokuUniversity #MaterialsScience bit.ly/4ryAB1H

Physics-Grounded Materials AI for Reliable Materials Discovery

A new perspective paper published by Tohoku University researchers developed a framework for incorporating physics-based principles into AI to generate more interpretable, testable, and meaningful...

tohoku.ac.jp
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thermoelectrics retweeted
Robert Palgrave
@Robert_PalgraveSep 23
Learning Rietveld refinement with pxrd data is hard because it takes time to visualise what effect each of the parameters has on your model. Until you do that, it's difficult to know what to refine. So I built a tool in Claude Opus 5.5 that looks like GSAS-II, but allows you to change parameters manually and see the effect on the model straight away. (link in first reply) It has some preloaded datasets or can load cifs or even full GSAS-II projects. Hopefully this will be a helpful tool for those looking to get to grips with this kind of data analysis. Let me know what you think!
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Kanishka Biswas@kanishkabiswasSep 20
The power of "Confined Disorder". Research highlight in Nature Review Materials based on our recent Science Advances nature.com/articles/s41578-0… @jncasr @ANRFIndia @IndiaDST @ScienceAdvances

The power of confined disorder

Nature Reviews Materials - An article in Science Advances shows that confined copper ion dynamics in TiCu5Se3 induce strong anharmonic lattice vibrations and wave-like thermal transport, achieving...

nature.com
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ICT & ECT 2027
@ict_ect_2027Sep 16
☀️Join us at the Palacio de Congresos de Torremolinos, June 6-10, 2027, for the 43rd International & 23rd European Conference on Thermoelectrics! ☀️ Seaside venue near Málaga 🔬 World-leading speakers & research 👉 premc.org/ict2027/venue/ #ICTECT2027 #Torremolinos #Spain
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James Zou@james_y_zouSep 16
Thrilled that #paper2agent is published in @nature today! Scientific knowledge is traditionally stored in passive papers. Paper2Agent transforms papers into virtual authors that answer questions, apply its methods and collaborate w/ other paper agents to make new discoveries 🧵
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Sol@Marisol_CSICSep 14
Maybe this review doi.org/10.1063/5.0341326 be of interest for discussion at our @SUSTENET meeting tomorrow at #ETC2026! #CA24120 #SUSTENET @ect2026
Instituto de Micro y Nanotecnología (IMN-CNM,CSIC)@ImnCsicSep 14
💡Investigadoras del grupo @FinderDevices han revisado el potencial de los nuevos materiales termoeléctricos sostenibles para generar electricidad a partir del calor y refrigerar de forma más eficiente🌱 @CSIC @Ausjux @CVManzano @Marisol_CSIC pubs.aip.org/aip/ape/article…

Sustainable thermoelectric materials based on metallic alloys and intermetallic compounds

This review provides an overview of recent advances in metallic and intermetallic alloys, which have emerged as promising alternatives to traditional semiconduc

pubs.aip.org
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