Kinetics of chemical ordering in a Ag-Pt nanoalloy particle via first-principles simulations

Ag-Au nanoclusters: Structure and phase segregation

(2011) D. Belić et al.   APPLIED PHYSICS LETTERS

Free gold clusters: beyond the static, monostructure description

(2011) Elizabeth C. Beret et al.   FARADAY DISCUSSIONS

Patchy Multishell Segregation in Pd−Pt Alloy Nanoparticles

(2011) Giovanni Barcaro et al.   NANO LETTERS

Simulation of vacancy diffusion in a silver nanocluster

(2010) Farid Taherkhani et al.   CHEMICAL PHYSICS LETTERS

Structural Order-Disorder Transitions and Phonon Conductivity of Partially Filled Skutterudites

(2010) Hyoungchul Kim et al.   PHYSICAL REVIEW LETTERS

From multiply twinned to fcc nanoparticles via irradiation-induced transient amorphization

(2009) T. T. Järvi et al.   EPL

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

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

Cluster expansion method for multicomponent systems based on optimal selection of structures for density-functional theory calculations

(2009) Atsuto Seko et al.   PHYSICAL REVIEW B

Equilibrium ordering properties of Au–Pd alloys and nanoalloys

(2009) Ivailo Atanasov et al.   SURFACE SCIENCE

Theoretical and experimental studies of Ag–Pt interactions for supported Ag–Pt bimetallic catalysts

(2009) Melanie T. Schaal et al.   SURFACE SCIENCE

Optical properties and relaxation processes at femtosecond scale of bimetallic clusters

(2008) M. Broyer et al.   FARADAY DISCUSSIONS

Nanoalloys: tuning properties and characteristics through size and composition

(2008) Julius Jellinek   FARADAY DISCUSSIONS

Structure and energetics of equiatomic K–Cs and Rb–Cs binary clusters

(2008) Elisaveta Hristova et al.   JOURNAL OF CHEMICAL PHYSICS

Structural motifs, mixing, and segregation effects in 38-atom binary clusters

(2008) Lauro Oliver Paz-Borbón et al.   JOURNAL OF CHEMICAL PHYSICS

Segregation, core alloying, and shape transitions in bimetallic nanoclusters: Monte Carlo simulations

(2008) F. Calvo et al.   PHYSICAL REVIEW B

Configurational thermodynamics of alloys from first principles: effective cluster interactions

(2008) A V Ruban et al.   REPORTS ON PROGRESS IN PHYSICS

Solid-solution precursor to melting in onion-ring Pd–Pt nanoclusters: a case of second-order-like phase change?

(2007) Florent Calvo   FARADAY DISCUSSIONS

Structure and chemical ordering in CoPt nanoalloys

(2007) G. Rossi et al.   FARADAY DISCUSSIONS

Searching for the optimum structures of alloy nanoclusters

(2007) Riccardo Ferrando et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS