Research

Areas

Computational Materials Science

Atomic Clusters

Superatomic Clusters: Superhalogens & Superalkalis

Electronic Transport Properties

Single Molecule Devices

NLO Materials

Alkalides

Energy Storage: Hydrogen Storage, Lithium Ion Batteries

Organic Electronics

Computational Nanoscience

Fullerenes

Nanotubes

Graphene

Nanoclusters


Computational Biophysics

Biologically Active Molecules: Synthetic Compounds, Natural Products

Quantum Chemical Study

QTAIM Analysis

Molecular Docking

Biological Activity Prediction


Projects

Superatoms as Building Blocks of Novel Materials for Various Applications: A Computational Approach

Funding Agency: University Grants Commission (UGC), India

Sanction No.: 30-466/2019(BSR)

Budget: 10,00,000 INR

Project Duration: 2019-2021

Current Status: Ongoing


Computational Exploration of Superatomic Clusters and Their Potential Applications in a Variety of Fields

Funding Agency: Science & Engineering Research Board (SERB), India

Sanction No.: PDF/2016/001784

Budget: 10,70,000 INR

Project Duration: 2017

Current Status: Completed