Band Structures and Transport Properties of High-Performance Half-Heusler Thermoelectric Materials by First Principles
Published 2018 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
Band Structures and Transport Properties of High-Performance Half-Heusler Thermoelectric Materials by First Principles
Authors
Keywords
-
Journal
Materials
Volume 11, Issue 5, Pages 847
Publisher
MDPI AG
Online
2018-05-21
DOI
10.3390/ma11050847
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Enhanced Thermoelectric Performance in 18-Electron Nb0.8 CoSb Half-Heusler Compound with Intrinsic Nb Vacancies
- (2018) Kaiyang Xia et al. ADVANCED FUNCTIONAL MATERIALS
- Impact of Ni content on the thermoelectric properties of half-Heusler TiNiSn
- (2018) Yinglu Tang et al. Energy & Environmental Science
- A valence balanced rule for discovery of 18-electron half-Heuslers with defects
- (2018) Shashwat Anand et al. Energy & Environmental Science
- High performance p-type half-Heusler thermoelectric materials
- (2018) Junjie Yu et al. JOURNAL OF PHYSICS D-APPLIED PHYSICS
- On the Phase Separation in n-Type Thermoelectric Half-Heusler Materials
- (2018) Michael Schwall et al. Materials
- Computational prediction of high thermoelectric performance in p-type half-Heusler compounds with low band effective mass
- (2017) Teng Fang et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Advances in thermoelectric materials research: Looking back and moving forward
- (2017) Jian He et al. SCIENCE
- Unique Role of Refractory Ta Alloying in Enhancing the Figure of Merit of NbFeSb Thermoelectric Materials
- (2017) Junjie Yu et al. Advanced Energy Materials
- Computationally guided discovery of thermoelectric materials
- (2017) Prashun Gorai et al. Nature Reviews Materials
- The Origin of Ultralow Thermal Conductivity in InTe: Lone-Pair-Induced Anharmonic Rattling
- (2016) Manoj K. Jana et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Recent advances in high-performance bulk thermoelectric materials
- (2016) X. Shi et al. INTERNATIONAL MATERIALS REVIEWS
- Electronic structure and thermoelectric properties of p-type half-Heusler compound NbFeSb: a first-principles study
- (2016) Teng Fang et al. RSC Advances
- Unraveling the dominant phonon scattering mechanism in the thermoelectric compound ZrNiSn
- (2016) Ankita Katre et al. Journal of Materials Chemistry A
- A novel p-type half-Heusler from high-throughput transport and defect calculations
- (2016) Sandip Bhattacharya et al. Journal of Materials Chemistry C
- Engineering half-Heusler thermoelectric materials using Zintl chemistry
- (2016) Wolfgang G. Zeier et al. Nature Reviews Materials
- On the tuning of electrical and thermal transport in thermoelectrics: an integrated theory–experiment perspective
- (2016) Jiong Yang et al. npj Computational Materials
- Full-scale computation for all the thermoelectric property parameters of half-Heusler compounds
- (2016) A. J. Hong et al. Scientific Reports
- Band engineering of high performance p-type FeNbSb based half-Heusler thermoelectric materials for figure of merit zT > 1
- (2015) Chenguang Fu et al. Energy & Environmental Science
- Ab initiophonon properties of half-Heusler NiTiSn, NiZrSn and NiHfSn
- (2015) Luc Andrea et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- A new n-type half-Heusler thermoelectric material NbCoSb
- (2015) Lihong Huang et al. MATERIALS RESEARCH BULLETIN
- Prediction and accelerated laboratory discovery of previously unknown 18-electron ABX compounds
- (2015) Romain Gautier et al. Nature Chemistry
- High-throughput exploration of alloying as design strategy for thermoelectrics
- (2015) Sandip Bhattacharya et al. PHYSICAL REVIEW B
- Realizing high figure of merit in heavy-band p-type half-Heusler thermoelectric materials
- (2015) Chenguang Fu et al. Nature Communications
- High Efficiency Half-Heusler Thermoelectric Materials for Energy Harvesting
- (2015) Tiejun Zhu et al. Advanced Energy Materials
- Demonstration of a phonon-glass electron-crystal strategy in (Hf,Zr)NiSn half-Heusler thermoelectric materials by alloying
- (2015) Yintu Liu et al. Journal of Materials Chemistry A
- Nanograined Half-Heusler Semiconductors as Advanced Thermoelectrics: An Ab Initio High-Throughput Statistical Study
- (2014) Jesús Carrete et al. ADVANCED FUNCTIONAL MATERIALS
- High-Performance Pseudocubic Thermoelectric Materials from Non-cubic Chalcopyrite Compounds
- (2014) Jiawei Zhang et al. ADVANCED MATERIALS
- Nanoscale structural heterogeneity in Ni-rich half-Heusler TiNiSn
- (2014) Jason E. Douglas et al. JOURNAL OF APPLIED PHYSICS
- Electronic structure of Zr–Ni–Sn systems: role of clustering and nanostructures in half-Heusler and Heusler limits
- (2014) Dat T Do et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- Ultralow thermal conductivity and high thermoelectric figure of merit in SnSe crystals
- (2014) Li-Dong Zhao et al. NATURE
- High-throughput computational screening of thermal conductivity, Debye temperature, and Grüneisen parameter using a quasiharmonic Debye model
- (2014) Cormac Toher et al. PHYSICAL REVIEW B
- High Band Degeneracy Contributes to High Thermoelectric Performance in p-Type Half-Heusler Compounds
- (2014) Chenguang Fu et al. Advanced Energy Materials
- Shifting up the optimum figure of merit of p-type bismuth telluride-based thermoelectric materials for power generation by suppressing intrinsic conduction
- (2014) Li-Peng Hu et al. NPG Asia Materials
- Finding Unprecedentedly Low-Thermal-Conductivity Half-Heusler Semiconductors via High-Throughput Materials Modeling
- (2014) Jesús Carrete et al. Physical Review X
- Beneficial Contribution of Alloy Disorder to Electron and Phonon Transport in Half-Heusler Thermoelectric Materials
- (2013) Hanhui Xie et al. ADVANCED FUNCTIONAL MATERIALS
- Enhanced phonon scattering by mass and strain field fluctuations in Nb substituted FeVSb half-Heusler thermoelectric materials
- (2013) Chenguang Fu et al. JOURNAL OF APPLIED PHYSICS
- Electronic structure and thermoelectric properties of half-Heusler Zr0.5Hf0.5NiSn by first-principles calculations
- (2013) D. F. Zou et al. JOURNAL OF APPLIED PHYSICS
- Electron and phonon transport in Co-doped FeV0.6Nb0.4Sb half-Heusler thermoelectric materials
- (2013) Chenguang Fu et al. JOURNAL OF APPLIED PHYSICS
- Power factor enhancement in light valence band p-type skutterudites
- (2012) Jiong Yang et al. APPLIED PHYSICS LETTERS
- Interrelation between atomic switching disorder and thermoelectric properties of ZrNiSn half-Heusler compounds
- (2012) Han-Hui Xie et al. CRYSTENGCOMM
- Low effective mass leading to high thermoelectric performance
- (2012) Yanzhong Pei et al. Energy & Environmental Science
- Lone pair electrons minimize lattice thermal conductivity
- (2012) Michele D. Nielsen et al. Energy & Environmental Science
- Thermoelectric properties of FeVSb half-Heusler compounds by levitation melting and spark plasma sintering
- (2012) Chenguang Fu et al. INTERMETALLICS
- Phase separation as a key to a thermoelectric high efficiency
- (2012) Michael Schwall et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Recent Advances in Nanostructured Thermoelectric Half-Heusler Compounds
- (2012) Wenjie Xie et al. Nanomaterials
- Improvement of thermoelectric properties for half-Heusler TiNiSn by interstitial Ni defects
- (2011) Hirofumi Hazama et al. JOURNAL OF APPLIED PHYSICS
- Convergence of electronic bands for high performance bulk thermoelectrics
- (2011) Yanzhong Pei et al. NATURE
- Trends in electrical transport ofp-type skutteruditesRFe4Sb12(R=Na, K, Ca, Sr, Ba, La, Ce, Pr, Yb) from first-principles calculations and Boltzmann transport theory
- (2011) Jiong Yang et al. PHYSICAL REVIEW B
- Simple rules for the understanding of Heusler compounds
- (2011) Tanja Graf et al. PROGRESS IN SOLID STATE CHEMISTRY
- Assessing the Thermoelectric Properties of Sintered Compounds via High-ThroughputAb-InitioCalculations
- (2011) Shidong Wang et al. Physical Review X
- Vacancy site occupation by Co and Ir in half-Heusler ZrNiSn and conversion of the thermoelectric properties from n-type to p-type
- (2010) Yoshisato Kimura et al. ACTA MATERIALIA
- Thermoelectric properties and electronic structure of substituted Heusler compounds: NiTi0.3−xScxZr0.35Hf0.35Sn
- (2010) Siham Ouardi et al. APPLIED PHYSICS LETTERS
- Effect of antisite defects on band structure and thermoelectric performance of ZrNiSn half-Heusler alloys
- (2010) Pengfei Qiu et al. APPLIED PHYSICS LETTERS
- The proof and measurement of association between two things
- (2010) C Spearman INTERNATIONAL JOURNAL OF EPIDEMIOLOGY
- Synthesis and thermoelectric properties of fine-grained FeVSb system half-Heusler compound polycrystals with high phase purity
- (2010) Minmin Zou et al. JOURNAL OF PHYSICS D-APPLIED PHYSICS
- Evaluation of Half-Heusler Compounds as Thermoelectric Materials Based on the Calculated Electrical Transport Properties
- (2008) Jiong Yang et al. ADVANCED FUNCTIONAL MATERIALS
- In-gap Electronic States Responsible for the Excellent Thermoelectric Properties of Ni-based Half-Heusler Alloys
- (2008) Koji Miyamoto et al. Applied Physics Express
- Complex thermoelectric materials
- (2008) G. Jeffrey Snyder et al. NATURE MATERIALS
- First-principles calculation of carrier-phonon scattering inn-typeSi1−xGexalloys
- (2008) F. Murphy-Armando et al. PHYSICAL REVIEW B
- Intrinsically Minimal Thermal Conductivity in CubicI−V−VI2Semiconductors
- (2008) D. T. Morelli et al. PHYSICAL REVIEW LETTERS
Add your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload NowAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started