Rajeev Ahuja

Research interests

Publications

• How to avoid dendrite formation in metal batteries: Innovative strategies for dendrite suppression

  Nano Energy · 2021 · 10.1016/j.nanoen.2021.106142

• High Thermoelectric Performance in Two-Dimensional Janus Monolayer Material WS-X ( X = Se and Te)

  ACS Applied Materials & Interfaces · 2020 · 10.1021/acsami.0c13960

• Terahertz plasmonics: The rise of toroidal metadevices towards immunobiosensings

  Materials Today · 2019 · 10.1016/j.mattod.2019.08.002

• Rational Design: A High-Throughput Computational Screening and Experimental Validation Methodology for Lead-Free and Emergent Hybrid Perovskites

  ACS Energy Letters · 2017 · https://doi.org/10.1021/acsenergylett.7b00035

• Designing strategies to tune reduction potential of organic molecules for sustainable high capacity battery application

  Journal of Materials Chemistry A · 2017 · https://doi.org/10.1039/c6ta09760j

• ISBI Practice Guidelines for Burn Care

  Burns · 2016 · 10.1016/j.burns.2016.05.013

• Review of two-dimensional materials for photocatalytic water splitting from a theoretical perspective

  Catalysis Science & Technology · 2016 · 10.1039/c6cy02178f

• Defect Engineered g-C 3 N 4 for Efficient Visible Light Photocatalytic Hydrogen Production

  Chemistry of Materials · 2015 · https://doi.org/10.1021/acs.chemmater.5b02344

• Hydrogen Storage Materials for Mobile and Stationary Applications: Current State of the Art

  ChemSusChem · 2015 · https://doi.org/10.1002/cssc.201500231

• Design of High-Efficiency Visible-Light Photocatalysts for Water Splitting: MoS 2 /AlN(GaN) Heterostructures

  The Journal of Physical Chemistry C · 2014 · 10.1021/jp5038014

• Strain Engineering for Phosphorene: The Potential Application as a Photocatalyst

  The Journal of Physical Chemistry C · 2014 · 10.1021/jp508618t

• Single-layer MoS2 as an efficient photocatalyst

  Catalysis Science & Technology · 2013 · 10.1039/c3cy00207a

• The Effect of Rural-to-Urban Migration on Obesity and Diabetes in India: A Cross-Sectional Study

  PLoS Medicine · 2010 · 10.1371/journal.pmed.1000268

• Li+ ion conductivity and diffusion mechanism in α-Li3N and β-Li3N

  Energy & Environmental Science · 2010 · https://doi.org/10.1039/c0ee00052c

• Phonon related properties of transition metals, their carbides, and nitrides: A first-principles study

  Journal of Applied Physics · 2007 · 10.1063/1.2747230

• The Importance of Strong Carbon−Metal Adhesion for Catalytic Nucleation of Single-Walled Carbon Nanotubes

  Nano Letters · 2007 · 10.1021/nl072431m

• Physisorption of nucleobases on graphene: Density-functional calculations

  Physical Review B · 2007 · 10.1103/physrevb.76.033401

• Structure of Phase Change Materials for Data Storage

  Physical Review Letters · 2006 · 10.1103/physrevlett.96.055507

• Deposition and characterization of ternary thin films within the Ti–Al–C system by DC magnetron sputtering

  Journal of Crystal Growth · 2006 · https://doi.org/10.1016/j.jcrysgro.2006.03.008

• Theoretical investigation of the bonding and elastic properties of nanolayered ternary nitrides

  Physical Review B · 2005 · 10.1103/physrevb.71.193402

• Bonding and classification of nanolayered ternary carbides

  Physical Review B · 2004 · 10.1103/physrevb.70.092102

• Ferromagnetism above room temperature in bulk and transparent thin films of Mn-doped ZnO

  Nature Materials · 2003 · https://doi.org/10.1038/nmat984

• Calculated elastic properties of M2AlC (M=Ti, V, Cr, Nb and Ta)

  Solid State Communications · 2003 · 10.1016/j.ssc.2003.12.008

• Cubic Hf 3 N 4 and Zr 3 N 4 : A class of hard materials

  Physical review. B, Condensed matter · 2003 · 10.1103/physrevb.68.184108

• Experimental evidence for sub-3-fs charge transfer from an aromatic adsorbate to a semiconductor

  Nature · 2002 · 10.1038/nature00952

• The hardest known oxide

  Nature · 2001 · 10.1038/35070650

• Electronic, bonding, and optical properties of CeO2 and Ce2O3 from first principles

  Physical review. B, Condensed matter · 2001 · 10.1103/physrevb.64.115108

• Quasi–Ab InitioMolecular Dynamic Study of Fe Melting

  Physical Review Letters · 2000 · 10.1103/physrevlett.84.3638

• Structural, elastic, and high-pressure properties of cubic TiC, TiN, and TiO

  Physical review. B, Condensed matter · 1996 · 10.1103/physrevb.53.3072

Current projects

No projects listed.