Assessing the Thermoelectric Properties of Sintered Compounds via High-ThroughputAb-InitioCalculations

A high-throughput infrastructure for density functional theory calculations

(2011) Anubhav Jain et al.   COMPUTATIONAL MATERIALS SCIENCE

Thermoelectric transport properties of silicon: Toward anab initioapproach

(2011) Zhao Wang et al.   PHYSICAL REVIEW B

High-Throughput Combinatorial Database of Electronic Band Structures for Inorganic Scintillator Materials

(2011) Wahyu Setyawan et al.   ACS Combinatorial Science

Potential Thermoelectric Performance from Optimization of Hole-DopedBi2Se3

(2011) David Parker et al.   Physical Review X

Nanostructured Thermoelectrics: Big Efficiency Gains from Small Features

(2010) Christopher J. Vineis et al.   ADVANCED MATERIALS

High-throughput electronic band structure calculations: Challenges and tools

(2010) Wahyu Setyawan et al.   COMPUTATIONAL MATERIALS SCIENCE

Thermoelectric properties of nanostructured Si1−xGex and potential for further improvement

(2010) Chandan Bera et al.   JOURNAL OF APPLIED PHYSICS

Thermoelectric properties and crystallographic shear structures in titanium oxides of the Magnèli phases

(2010) Shunta Harada et al.   JOURNAL OF APPLIED PHYSICS

Uncovering Compounds by Synergy of Cluster Expansion and High-Throughput Methods

(2010) Ohad Levy et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

First-principles calculations of electron mobilities in silicon: Phonon and Coulomb scattering

(2009) O. D. Restrepo et al.   APPLIED PHYSICS LETTERS

Unique nanostructures and enhanced thermoelectric performance of melt-spun BiSbTe alloys

(2009) Wenjie Xie et al.   APPLIED PHYSICS LETTERS

The New Face of Rhodium Alloys: Revealing Ordered Structures from First Principles

(2009) Ohad Levy et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Electronic structure and thermoelectric properties of layeredPbSe-WSe2materials

(2009) Lijun Zhang et al.   PHYSICAL REVIEW B

Enhanced thermoelectric figure of merit in nanostructured n-type silicon germanium bulk alloy

(2008) X. W. Wang et al.   APPLIED PHYSICS LETTERS

Data mining and accelerated electronic structure theory as a tool in the search for new functional materials

(2008) C. Ortiz et al.   COMPUTATIONAL MATERIALS SCIENCE

Giant improvement of thermoelectric power factor of Bi2Te3 under pressure

(2008) Sergey V. Ovsyannikov et al.   JOURNAL OF APPLIED PHYSICS

Enhanced Thermoelectric Figure-of-Merit in Nanostructured p-type Silicon Germanium Bulk Alloys

(2008) Giri Joshi et al.   NANO LETTERS

First-principles calculation of carrier-phonon scattering inn-typeSi1−xGexalloys

(2008) F. Murphy-Armando et al.   PHYSICAL REVIEW B

High-Thermoelectric Performance of Nanostructured Bismuth Antimony Telluride Bulk Alloys

(2008) B. Poudel et al.   SCIENCE

Cooling, Heating, Generating Power, and Recovering Waste Heat with Thermoelectric Systems

(2008) Lon E. Bell   SCIENCE