Publication list
Publication list
2012
Autocatalytic and Cooperatively Stabilized Dissociation of Water on a Stepped Platinum Surface
D Donadio, LM Ghiringhelli, L Delle Site
J Am Chem Soc vol. 134 pp. 19217 (2012)
Lattice thermal conductivity of semiconducting bulk materials: atomistic simulations
YP He, I Savic, D Donadio, G Galli
Phys Chem Chem Phys vol. 14 pp. 16209 (2012)
Adsorption of Dichlorobenzene on Au and Pt Stepped Surfaces Using van der Waals Density Functional Theory
R Pekoz, K Johnston, D Donadio
J Phys Chem C (2012) vol. 116 pp. 20409
Thermal transport in phase-change materials from atomistic simulations
G C Sosso, D Donadio, S Caravati, J Behler, M Bernasconi
Phys Rev B (2012), vol. 86, 104301
Atomistic simulations of heat transport in real-scale silicon nanowire devices
I Duchemin, D Donadio
Appl. Phys. Lett. (2012), vol. 100 pp. 223107
Ab initio characterization of graphene nanoribbons and their polymer precursors
R Pekoz, X Feng, D Donadio
J. Phys.: Condens. Matter (2012) vol. 24 pp. 104023
2011
Homogeneous Ice nucleation from supercooled water
TS Li, D Donadio, G Russo, G Galli
Phys Chem Chem Phys (2011) vol. 13 pp. 19807
http://pubs.rsc.org/en/content/articlelanding/2011/cp/c1cp22167a
Atomistic calculation of the thermal conductance of large scale bulk-nanowire junctions
I Duchemin, D Donadio
Phys Rev B (2011) vol. 84 pp. 115423
http://prb.aps.org/abstract/PRB/v84/i11/e115423
Proton wires via one dimensional water chains adsorbed on metallic steps
R Scipioni, D Donadio, LM Ghiringhelli, L Delle Site
J Chem Theo Comp (2011) vol. 7 pp. 2681
http://pubs.acs.org/doi/abs/10.1021/ct200326u
Morphology and Temperature Dependence of the Thermal Conductivity of Nanoporous SiGe
YP He, D Donadio, G Galli
Nano Lett (2011) vol. 11 pp. 3935
http://pubs.acs.org/doi/abs/10.1021/nl201359q
Stability of hydrocarbons at deep Earth pressures and temperatures.
L Spanu, D Donadio, E Schwegler, D Hohl, G Galli
P Natl Acad Sci Usa (2011) vol. 108 (17) pp. 6843-6846
http://dx.doi.org/10.1073/pnas.1014804108
Heat transport in amorphous silicon: Interplay between morphology and disorder.
YP He, D Donadio, G Galli
Appl. Phys. Lett. (2011) vol. 98 (14) pp. 144101
http://dx.doi.org/10.1063/1.3574366
Thermal Transport in Nanoporous Silicon: Interplay between Disorder at Mesoscopic and Atomic Scales.
YP He, D Donadio, J-H Lee, JC Grossman, G Galli
Acs Nano (2011) vol. 5 (3) pp. 1839-1844
http://pubs.acs.org/doi/abs/10.1021/nn2003184
2010
First-Principle Analysis of the IR Stretching Band of Liquid Water.
C Zhang, D Donadio, G Galli.
J Phys Chem Lett (2010) vol. 1 (9) pp. 1398-1402
http://dx.doi.org/10.1021/jz100232z
Ab initio investigation of the melting line of nitrogen at high pressure.
D Donadio, L Spanu, I Duchemin, F Gygi, G Galli.
Phys Rev B (2010) vol. 82 (2) pp. 020102
http://prb.aps.org/abstract/PRB/v82/i2/e020102
Temperature Dependence of the Thermal Conductivity of Thin Silicon Nanowires.
D Donadio, G Galli.
Nano Lett. (2010) vol. 10 (3) pp. 847-851
http://pubs.acs.org/doi/abs/10.1021/nl903268y
THERMOELECTRIC MATERIALS Silicon stops heat in its tracks.
G Galli, D Donadio.
Nature Nanotech. (2010) vol. 5 (10) pp. 701-702
http://www.nature.com/nnano/journal/v5/n10/full/nnano.2010.199.html
Cluster expansion and optimization of thermal conductivity in SiGe nanowires.
MKY Chan, J Reed, D Donadio, T Mueller, YS Meng, G Galli, G Ceder.
Phys Rev B (2010) vol. 81 (17) pp. 174303
http://prb.aps.org/abstract/PRB/v81/i17/e174303
Exploring the Rehydroxylation Reaction of Pyrophyllite by Ab Initio Molecular Dynamics.
E Molina-Montes, D Donadio, A Hernandez-Laguna, C Ignacio Sainz-Diaz.
J Phys Chem B (2010) vol. 114 (22) pp. 7593-7601
http://pubs.acs.org/doi/abs/10.1021/jp102239k