Researches
- Current Research Interest:
- Computer simulations: Monte Carlo, Molecular Dynamics, minimizations techniques
- Modeling of adsorption and phase transformations in confined geometry
- Carbon-based adsorbents: nanoporous carbons, fullerenes, nanotubes
- Modeling of auto-assembly in polymers and proteins; coarse-grained and atomistic approaches
- Hydrogen and natural gas storage materials for fuel cells qpplications
- Current & Past Research Topics:
- Adsorptive-limited deformation of zeolites under pressure
- Fluids' transport in carbon nanotubes
- Gas storage in MOF's
- Amelogenine adsorption on hydroxyapatite
- Natural gas storage in carbon slit pores
- Hydrogen storage in B-substituted carbons
- Physical limits of H2 storage in nanoporous carbons
- Flexibility - driven phase transitions in C24H50 adlayers on graphite
- Melting of hexane adsorbed on graphite
- Non-universality of scaling interactions in CHARMM force field
- Heterogeneity of nitrogen multilayers on graphite
- Modeling of adsorption on heterogeneous surfaces
- Phase transitions in confined geometries
- Rare gases adsorption in carbon
- Modeling of gas adsorption in MCM-41
- High pressure phase diagram of N2
- Phase transitions in incommensurate noble gases adlayers on graphite
- Phase transitions in glassy crystals: cyanoadamantane
- Noble metals diffusion in fullerenes thin films
- 13C HR CP-MAS NMR study of fullerenes C60 and C70 dynamics
- Stereometry of bi-thiophenes and poly-alkylthiophenes
- Knight shift in low dimensional organic conductor
- Electric transport in 1D conductors derivatives of TCNQ and BEDT-TTF
- EPR study of radicals in gamma-irradiated vitamines