Catalysts for clean energy solutions
Fuel cell electode materials

Excellent hydrogen oxidation activity for combined palladium-ceria anode catalysts for AEM fuel cells.
Single Atom Catalysis

Activating methane for graphene supported single atom transition metals.
Adsorbent Materials for Carbon Capture

Amine functionalized porous polymers and molybdenum disulphide-based materials for carbon dioxide capture.
Aeorspace materials under extreme conditions
Interaction of atmospheric molecules with titanium

Phase stability diagrams of titanium as a function of temperature and gas partial pressure.
Interaction of light with aerospace materials

Wavelength-dependent dielectric function for nickel-based super alloys.
Precipitation modelling in aluminum-based casting alloys

Silicon precipitates morphological stability in aluminum-silicon binary alloys.
Nanoclusters and magnetism
Stabilty of free and supported transition metal clusters

Segregation and mixing effect in closed shell elemental and icosahedral clusters.
Spin-orbit induced properties of binary nano clusters

Spin and orbital magnetic moments in binary (Fe, Co and Ni)-Pt clusters.
Magnetic anisotropy of graphene-supported clusters

Enhanced magnetic anisotropy and orbital moments for supported Ni cluster on graphene flake indicating the easy and hard axes.