Phonon transmission acrossMg2Si/Mg2Si1−xSnxinterfaces: A first-principles-based atomistic Green's function study

Resonant bonding leads to low lattice thermal conductivity

(2014) Sangyeop Lee et al.   Nature Communications

Nanoscale thermal transport. II. 2003–2012

(2014) David G. Cahill et al.   Applied Physics Reviews

Phonon transmission and thermal conductance across graphene/Cu interface

(2013) Liang Chen et al.   APPLIED PHYSICS LETTERS

Importance of local force fields on lattice thermal conductivity reduction in PbTe1−xSexalloys

(2013) Takuru Murakami et al.   EPL

Predicting alloy vibrational mode properties using lattice dynamics calculations, molecular dynamics simulations, and the virtual crystal approximation

(2013) Jason M. Larkin et al.   JOURNAL OF APPLIED PHYSICS

Phonon scattering of interfacial strain field between dissimilar lattices

(2013) Qingping Meng et al.   PHYSICAL REVIEW B

Ab initiothermal transport in compound semiconductors

(2013) L. Lindsay et al.   PHYSICAL REVIEW B

Size-dependent phonon transmission across dissimilar material interfaces

(2012) Xiaobo Li et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Effect of lattice mismatch on phonon transmission and interface thermal conductance across dissimilar material interfaces

(2012) Xiaobo Li et al.   PHYSICAL REVIEW B

Enhancing phonon transmission across a Si/Ge interface by atomic roughness: First-principles study with the Green's function method

(2012) Zhiting Tian et al.   PHYSICAL REVIEW B

Phonon conduction in PbSe, PbTe, and PbTe1−xSexfrom first-principles calculations

(2012) Zhiting Tian et al.   PHYSICAL REVIEW B

Thermal conductivity of bulk and nanowire Mg2SixSn1−xalloys from first principles

(2012) Wu Li et al.   PHYSICAL REVIEW B

Coherent Phonon Heat Conduction in Superlattices

(2012) M. N. Luckyanova et al.   SCIENCE

An atomistic study of thermal conductance across a metal-graphene nanoribbon interface

(2011) Zhen Huang et al.   JOURNAL OF APPLIED PHYSICS

First-principles study of phonon linewidths in noble metals

(2011) Xiaoli Tang et al.   PHYSICAL REVIEW B

Heat transport in silicon from first-principles calculations

(2011) Keivan Esfarjani et al.   PHYSICAL REVIEW B

Role of Disorder and Anharmonicity in the Thermal Conductivity of Silicon-Germanium Alloys: A First-Principles Study

(2011) Jivtesh Garg et al.   PHYSICAL REVIEW LETTERS

Semiclassical model for thermoelectric transport in nanocomposites

(2010) Jun Zhou et al.   PHYSICAL REVIEW B

Improved thermoelectric properties of Mg2SixGeySn1−x−y nanoparticle-in-alloy materials

(2009) S. Wang et al.   APPLIED PHYSICS LETTERS

Phonon scattering at a rough interface between two fcc lattices

(2009) Hong Zhao et al.   JOURNAL OF APPLIED PHYSICS

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

“Nanoparticle-in-Alloy” Approach to Efficient Thermoelectrics: Silicides in SiGe

(2009) N. Mingo et al.   NANO LETTERS

Ab initiotheory of the lattice thermal conductivity in diamond

(2009) A. Ward et al.   PHYSICAL REVIEW B

High figures of merit and natural nanostructures in Mg2Si0.4Sn0.6 based thermoelectric materials

(2008) Q. Zhang et al.   APPLIED PHYSICS LETTERS

Lattice dynamics of Mg2Si and Mg2Ge compounds from first-principles calculations

(2008) Jun-ichi Tani et al.   COMPUTATIONAL MATERIALS SCIENCE

Quantum thermal transport in nanostructures

(2008) J.-S. Wang et al.   EUROPEAN PHYSICAL JOURNAL B

Modeling the Thermal Conductivity and Phonon Transport in Nanoparticle Composites Using Monte Carlo Simulation

(2008) Ming-Shan Jeng et al.   JOURNAL OF HEAT TRANSFER-TRANSACTIONS OF THE ASME

Phonon transmission through defects in carbon nanotubes from first principles

(2008) N. Mingo et al.   PHYSICAL REVIEW B

Method to extract anharmonic force constants from first principles calculations

(2008) Keivan Esfarjani et al.   PHYSICAL REVIEW B