2 papers
cond-mat.mtrl-sci2001
Effects of temperature and adsorbates on the composition profile of Pt-Rh nanocatalysts : A comparative study
Abir De Sarkar, Badal C. Khanra
Monte-Carlo simulation technique has been used to investigate the effect of temperature and adsorbed gases on the composition profile of unsupported Pt-Rh nanocatalysts. For a 2406…
cond-mat.mtrl-sci1999
Spatial distribution of atoms in gas-covered Pd-X nanoparticles (X= Ag, Cu, Ni, Pt)
Mahesh Menon, Badal C. Khanra
A Monte-carlo (MC) simulation procedure has been developed where the pair bond energies are allowed to take into account the various coordination numbers of surface atoms and the p…