Work in progress
 Dendrimers as nanoscale building blocks and nanoscale applications
 Modeling and characterization of Dendrimers for unimolecular imprinting
 Molecular modeling of Rod Coil Dendrimers
 Mesoscopic representation of Dendrimers from atomistic level simulations
 Dynamics of encapsulated metals within PAMAM dendrimers
 Thermodynamically consistent dendritic structures using CCBMC
 Metals and Alloys
 Melting and liquid structure at the surfaces in metals
 Simulations of Liquid Metals
 Complex oxides, Ferroelectrics, piezolectrics for sensing, actuation applications
 First principles and Dynamics modeling of PbBa titanates, Zirconates
 Dynamic Polarizable QEq Force fields for Oxides, Ceramics, Perovskites"

 Low dimensional systems, nanodots, nanowires, nanorods, and films
 Melting in low dimesions
 Nanotube mechanics
 Plasticity
 Hypervelocity impact in metals
 Nanoindentation of metals and ceramics
 Shock wave simulations
 Equation of State and Phase Diagrams of Materials
 Ab initio EoS studies of Metals and ordered metalic compounds
 High pressure and temperature phase diagrams of geological materials.