Jesús Carrete Montaña
Jesús Carrete Montaña
Instituto de Nanociencia y Materiales de Aragón, CSIC-Universidad de Zaragoza, Zaragoza, Spain
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ShengBTE: A solver of the Boltzmann transport equation for phonons
W Li, J Carrete, NA Katcho, N Mingo
Computer Physics Communications 185 (6), 1747–1758, 2014
BoltzTraP2, a program for interpolating band structures and calculating semi-classical transport coefficients
GKH Madsen, J Carrete, MJ Verstraete
Computer Physics Communications 231, 140-145, 2018
Finding unprecedentedly low-thermal-conductivity half-Heusler semiconductors via high-throughput materials modeling
J Carrete, W Li, N Mingo, S Wang, S Curtarolo
Physical Review X 4 (1), 011019, 2014
Phonon thermal transport in strained and unstrained graphene from first principles
L Lindsay, W Li, J Carrete, N Mingo, DA Broido, TL Reinecke
Physical Review B 89 (15), 155426, 2014
Thermal conductivity and phonon linewidths of monolayer MoS2 from first principles
W Li, J Carrete, N Mingo
Applied Physics Letters 103 (25), 2013
almaBTE: A solver of the space–time dependent Boltzmann transport equation for phonons in structured materials
J Carrete, B Vermeersch, A Katre, A van Roekeghem, T Wang, ...
Computer Physics Communications 220, 351-362, 2017
Low thermal conductivity and triaxial phononic anisotropy of SnSe
J Carrete, N Mingo, S Curtarolo
Applied Physics Letters 105 (10), 2014
Physically founded phonon dispersions of few-layer materials and the case of borophene
J Carrete, W Li, L Lindsay, DA Broido, LJ Gallego, N Mingo
Materials Research Letters 4 (4), 204-211, 2016
Ionic liquids: theory, properties, new approaches
A Kokorin
BoD–Books on Demand, 2011
Strong enhancement of phonon scattering through nanoscale grains in lead sulfide thermoelectrics
H Wu, J Carrete, Z Zhang, Y Qu, X Shen, Z Wang, LD Zhao, J He
NPG Asia Materials 6 (6), e108-e108, 2014
High-throughput computation of thermal conductivity of high-temperature solid phases: the case of oxide and fluoride perovskites
A van Roekeghem, J Carrete, C Oses, S Curtarolo, N Mingo
Physical Review X 6 (4), 041061, 2016
Nanograined Half‐Heusler Semiconductors as Advanced Thermoelectrics: An Ab Initio High‐Throughput Statistical Study
J Carrete, N Mingo, S Wang, S Curtarolo
Advanced Functional Materials 24 (47), 7427-7432, 2014
Unexpected High-Temperature Stability of β-Zn4Sb3 Opens the Door to Enhanced Thermoelectric Performance
J Lin, X Li, G Qiao, Z Wang, J Carrete, Y Ren, L Ma, Y Fei, B Yang, L Lei, ...
Journal of the American Chemical Society 136 (4), 1497-1504, 2014
Molecular dynamics simulation of the structure and dynamics of water–1-alkyl-3-methylimidazolium ionic liquid mixtures
T Mendez-Morales, J Carrete, O Cabeza, LJ Gallego, LM Varela
The Journal of Physical Chemistry B 115 (21), 6995-7008, 2011
Temperature and thickness dependences of the anisotropic in-plane thermal conductivity of black phosphorus
B Smith, B Vermeersch, J Carrete, E Ou, J Kim, N Mingo, D Akinwande, ...
Advanced Materials 29 (5), 2016
How chemical composition alone can predict vibrational free energies and entropies of solids
F Legrain, J Carrete, A van Roekeghem, S Curtarolo, N Mingo
Chemistry of Materials 29 (15), 6220-6227, 2017
Superdiffusive heat conduction in semiconductor alloys. I. Theoretical foundations
B Vermeersch, J Carrete, N Mingo, A Shakouri
Physical Review B 91 (8), 085202, 2015
Effect of nitrogen and vacancy defects on the thermal conductivity of diamond: An ab initio Green's function approach
NA Katcho, J Carrete, W Li, N Mingo
Physical Review B 90 (9), 094117, 2014
Solvation of lithium salts in protic ionic liquids: a molecular dynamics study
T Mendez-Morales, J Carrete, O Cabeza, O Russina, A Triolo, LJ Gallego, ...
The Journal of Physical Chemistry B 118 (3), 761-770, 2014
MD simulations of the formation of stable clusters in mixtures of alkaline salts and imidazolium-based ionic liquids
T Mendez-Morales, J Carrete, S Bouzon-Capelo, M Perez-Rodriguez, ...
The Journal of Physical Chemistry B 117 (11), 3207-3220, 2013
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