First-principle phonon thermal transport in graphene: Effects of exchange-correlation and type of pseudopotential

Analysis of the anomalies in graphene thermal properties

(2017) Khalil Khanafer et al.   INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER

Impacts of potential models on calculating the thermal conductivity of graphene using non-equilibrium molecular dynamics simulations

(2017) Chao Si et al.   INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER

Thermal conductivity of graphene mediated by strain and size

(2016) Youdi Kuang et al.   INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER

Effect of exchange–correlation on first-principles-driven lattice thermal conductivity predictions of crystalline silicon

(2015) Ankit Jain et al.   COMPUTATIONAL MATERIALS SCIENCE

First-principles prediction of phononic thermal conductivity of silicene: A comparison with graphene

(2015) Xiaokun Gu et al.   JOURNAL OF APPLIED PHYSICS

A four-probe thermal transport measurement method for nanostructures

(2015) Jaehyun Kim et al.   REVIEW OF SCIENTIFIC INSTRUMENTS

Magnetically-functionalized self-aligning graphene fillers for high-efficiency thermal management applications

(2015) J. Renteria et al.   MATERIALS & DESIGN

Strongly anisotropic in-plane thermal transport in single-layer black phosphorene

(2015) Ankit Jain et al.   Scientific Reports

ShengBTE: A solver of the Boltzmann transport equation for phonons

(2014) Wu Li et al.   COMPUTER PHYSICS COMMUNICATIONS

Full-dispersion Monte Carlo simulation of phonon transport in micron-sized graphene nanoribbons

(2014) S. Mei et al.   JOURNAL OF APPLIED PHYSICS

Phonon Lateral Confinement Enables Thermal Rectification in Asymmetric Single-Material Nanostructures

(2014) Yan Wang et al.   NANO LETTERS

Thermal Conductivity of Graphene and Graphite: Collective Excitations and Mean Free Paths

(2014) Giorgia Fugallo et al.   NANO LETTERS

Phonon thermal transport in strained and unstrained graphene from first principles

(2014) L. Lindsay et al.   PHYSICAL REVIEW B

Accuracy of generalized gradient approximation functionals for density-functional perturbation theory calculations

(2014) Lianhua He et al.   PHYSICAL REVIEW B

Length-dependent thermal conductivity in suspended single-layer graphene

(2014) Xiangfan Xu et al.   Nature Communications

Thermal Transport in Graphene Oxide – From Ballistic Extreme to Amorphous Limit

(2014) Xin Mu et al.   Scientific Reports

Molecular dynamics simulations of thermal conductivity of carbon nanotubes: Resolving the effects of computational parameters

(2013) Richard N. Salaway et al.   INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER

Length-dependent lattice thermal conductivity of graphene and its macroscopic limit

(2013) Minkyu Park et al.   JOURNAL OF APPLIED PHYSICS

Trends in Adsorption Characteristics of Benzene on Transition Metal Surfaces: Role of Surface Chemistry and van der Waals Interactions

(2013) Handan Yildirim et al.   Journal of Physical Chemistry C

Divergence of the thermal conductivity in uniaxially strained graphene

(2013) Luiz Felipe C. Pereira et al.   PHYSICAL REVIEW B

Anharmonic properties from a generalized third-orderab initioapproach: Theory and applications to graphite and graphene

(2013) Lorenzo Paulatto et al.   PHYSICAL REVIEW B

Ab initiothermal transport in compound semiconductors

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

Two-dimensional phonon transport in graphene

(2012) Denis L Nika et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Thermal properties of graphene: Fundamentals and applications

(2012) Eric Pop et al.   MRS BULLETIN

Direct Nanoscale Imaging of Ballistic and Diffusive Thermal Transport in Graphene Nanostructures

(2012) Manuel E. Pumarol et al.   NANO LETTERS

Acoustic Phonon Lifetimes and Thermal Transport in Free-Standing and Strained Graphene

(2012) Nicola Bonini et al.   NANO LETTERS

Graphene–Multilayer Graphene Nanocomposites as Highly Efficient Thermal Interface Materials

(2012) Khan M. F. Shahil et al.   NANO LETTERS

Thermal conductivity of isotopically modified graphene

(2012) Shanshan Chen et al.   NATURE MATERIALS

Configuring pnicogen rings in skutterudites for low phonon conductivity

(2012) Hang Chi et al.   PHYSICAL REVIEW B

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

(2012) Wu Li et al.   PHYSICAL REVIEW B

Graphene quilts for thermal management of high-power GaN transistors

(2012) Zhong Yan et al.   Nature Communications

Chirality and thickness-dependent thermal conductivity of few-layer graphene: A molecular dynamics study

(2011) Wei-Rong Zhong et al.   APPLIED PHYSICS LETTERS

Size-dependent model for thin film and nanowire thermal conductivity

(2011) Alan J. H. McGaughey et al.   APPLIED PHYSICS LETTERS

Mechanism of thermal conductivity reduction in few-layer graphene

(2011) Dhruv Singh et al.   JOURNAL OF APPLIED PHYSICS

On the lattice Boltzmann method for phonon transport

(2011) Aydin Nabovati et al.   JOURNAL OF COMPUTATIONAL PHYSICS

Flexural phonons and thermal transport in multilayer graphene and graphite

(2011) L. Lindsay 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

Thermal Conductivity of Graphene in Corbino Membrane Geometry

(2010) Clement Faugeras et al.   ACS Nano

Raman Measurements of Thermal Transport in Suspended Monolayer Graphene of Variable Sizes in Vacuum and Gaseous Environments

(2010) Shanshan Chen et al.   ACS Nano

Thermal conductivity of graphene ribbons from equilibrium molecular dynamics: Effect of ribbon width, edge roughness, and hydrogen termination

(2010) William J. Evans et al.   APPLIED PHYSICS LETTERS

Strain effects on the thermal conductivity of nanostructures

(2010) Xiaobo Li et al.   PHYSICAL REVIEW B

Thermal Conductivity of Periclase (MgO) from First Principles

(2010) Stephen Stackhouse et al.   PHYSICAL REVIEW LETTERS

Lattice thermal conductivity of graphene flakes: Comparison with bulk graphite

(2009) D. L. Nika et al.   APPLIED PHYSICS LETTERS

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

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

Phonon thermal conduction in graphene: Role of Umklapp and edge roughness scattering

(2009) D. L. Nika et al.   PHYSICAL REVIEW B

Three-phonon phase space and lattice thermal conductivity in semiconductors

(2008) L Lindsay et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Superior Thermal Conductivity of Single-Layer Graphene

(2008) Alexander A. Balandin et al.   NANO LETTERS

Impact of the electron-electron correlation on phonon dispersion: Failure of LDA and GGA DFT functionals in graphene and graphite

(2008) Michele Lazzeri et al.   PHYSICAL REVIEW B

Method to extract anharmonic force constants from first principles calculations

(2008) Keivan Esfarjani et al.   PHYSICAL REVIEW B