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2010

Physical Review B - Condensed Matter and Materials Physics, 82-14, 2010 doi:10.1103/PhysRevB.82.140101

Multiferroicity and orbital ordering in Pr0.5 Ca0.5 MnO3 from first principles

Colizzi Giuseppe, Filippetti Alessio, Fiorentini Vincenzo
Physica Status Solidi (B) Basic Research, 247-8:1920 – 1924, 2010 doi:10.1002/pssb.200983951

Many-body meets QM/MM: Application to indole in water solution

Conte Adriano Mosca, Ippoliti Emiliano, Del Sole Rodolfo, Carloni Paolo, Pulci Olivia
Physical Review B - Condensed Matter and Materials Physics, 82-14, 2010 doi:10.1103/PhysRevB.82.144302

Long time dynamics following a quench in an integrable quantum spin chain: Local versus nonlocal operators and effective thermal behavior

Rossini Davide, Suzuki Sei, Mussardo Giuseppe, Santoro Giuseppe E., Silva Alessandro
Physical Chemistry Chemical Physics, 12-38:11869 – 11877, 2010 doi:10.1039/c0cp00504e

A numerical study of one-patch colloidal particles: From square-well to Janus

Sciortino Francesco, Giacometti Achille, Pastore Giorgio
Physical Review Letters, 105-7, 2010 doi:10.1103/PhysRevLett.105.075502

Atomically smooth stress-corrosion cleavage of a hydrogen-implanted crystal

Moras Gianpietro, Ciacchi Lucio Colombi, Elsässer Christian, Gumbsch Peter, De Vita Alessandro
Catalysis Today, 154-1-2:68 – 74, 2010 doi:10.1016/j.cattod.2010.05.028

High-resolution fast X-ray photoelectron spectroscopy study of ethylene interaction with Ir(1 1 1): From chemisorption to dissociation and graphene formation

Lizzit Silvano, Baraldi Alessandro
Solid State Sciences, 12-11:1898 – 1902, 2010 doi:10.1016/j.solidstatesciences.2010.06.001

Active sol-gel thin film on nanostructured plasmonic surface

Pistore A., Guglielmi M., Brusatin G., Kang H.K., Ferraris C., Romanato F.
Physical Review B - Condensed Matter and Materials Physics, 82-12, 2010 doi:10.1103/PhysRevB.82.125112

Systematically convergent method for accurate total energy calculations with localized atomic orbitals

Azadi S., Cavazzoni C., Sorella S.
Journal of Chemical Physics, 133-6, 2010 doi:10.1063/1.3467877

Kohn's localization in the insulating state: One-dimensional lattices crystalline versus disordered

Bendazzoli Gian Luigi, Evangelisti Stefano, Monari Antonio, Resta Raffaele
Surface Science, 604-11-12:1015 – 1021, 2010 doi:10.1016/j.susc.2010.03.012

Effect of B4C diffusion barriers on the thermal stability of Sc/Si periodic multilayers

Jonnard Philippe, Maury Hélène, Le Guen Karine, André Jean-Michel, Mahne Nicola, Giglia Angelo, Nannarone Stefano, Bridou Françoise
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