All Stories

  1. Spectroscopic Identification of Active Sites of Oxygen‐Doped Carbon for Selective Oxygen Reduction to Hydrogen Peroxide

    Article • Angewandte Chemie International Edition, April 2023, Wiley

    Dr. Arunabhiram Chutia

  2. Computational modelling in catalytic science

    Article • Physical Chemistry Chemical Physics, January 2023, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  3. Periodic corner holes on the Si(111)-7×7 surface can trap silver atoms

    Article • Nature Communications, May 2022, Springer Science + Business Media

    Dr. Arunabhiram Chutia

  4. Synthesis, Structural Investigation, Hirshfeld Surface Analysis, and Biological Evaluation of N-(3-Cyanothiophen-2-yl)-2-(thiophen-2-yl)acetamide

    Article • ACS Omega, March 2022, American Chemical Society (ACS)

    Dr. Arunabhiram Chutia

  5. A comparative study on the stability of the furfural molecule on the low index Ni, Pd and Pt surfaces

    Article • Royal Society Open Science, March 2022, Royal Society Publishing

    Dr. Arunabhiram Chutia

  6. Structural investigations, Hirsfeld surface analyses, and molecular docking studies of a phenoxo-bridged binuclear Zinc(II) complex

    Article • Journal of Molecular Structure, March 2022, Elsevier

    Dr. Arunabhiram Chutia

  7. A study on the stability of gold copper bimetallic clusters on the CeO2(110) surface

    Article • Catalysis Communications, February 2022, Elsevier

    Dr. Arunabhiram Chutia

  8. Furfural Adsorption and Hydrogenation at the Oxide‐Metal Interface: Evidence of the Support Influence on the Selectivity of Iridium‐Based Catalysts

    Article • ChemCatChem, January 2022, Wiley

    Dr. Arunabhiram Chutia

  9. Adsorption of Transition Metal Catalysts on Carbon Supports: A Theoretical Perspective : Understanding the interaction between catalyst and catalyst supports

    Article • Johnson Matthey Technology Review, January 2022, Johnson Matthey

    Dr. Arunabhiram Chutia

  10. A computational investigation of the adsorption of small copper clusters on the CeO2(110) surface

    Article • Physical Chemistry Chemical Physics, January 2021, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  11. Palladium alloys used as electrocatalysts for the oxygen reduction reaction

    Article • Energy & Environmental Science, January 2021, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  12. Selectivity of the Lindlar catalyst in alkyne semi-hydrogenation: a direct liquid-phase adsorption study

    Article • Catalysis Science & Technology, January 2021, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  13. Unravelling charge-transfer in Pd to pyrrolic-N bond for superior electrocatalytic performance

    Article • Journal of Materials Chemistry A, January 2021, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  14. Surface-Oxygen Induced Electrochemical Self-Assembly of Mesoporous Conducting Polymers for Electrocatalysis

    Article • Journal of The Electrochemical Society, June 2020, The Electrochemical Society

    Dr. Arunabhiram Chutia

  15. Dual-Site-Mediated Hydrogenation Catalysis on Pd/NiO: Selective Biomass Transformation and Maintenance of Catalytic Activity at Low Pd Loading

    Article • ACS Catalysis, April 2020, American Chemical Society (ACS)

    Dr. Arunabhiram Chutia

  16. A DFT and KMC based study on the mechanism of the water gas shift reaction on the Pd(100) surface

    Article • Physical Chemistry Chemical Physics, January 2020, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  17. Size-dependent bond dissociation enthalpies in single-walled carbon nanotubes

    Article • Chemical Physics Letters, September 2019, Elsevier

    Dr. Arunabhiram Chutia

  18. Carbidisation of Pd Nanoparticles by Ethene Decomposition with Methane Production

    Article • ChemCatChem, July 2019, Wiley

    Dr. Arunabhiram Chutia

  19. Structural selectivity of supported Pd nanoparticles for catalytic NH3 oxidation resolved using combined operando spectroscopy

    Article • Nature Catalysis, January 2019, Springer Science + Business Media

    Dr. Arunabhiram Chutia

  20. Directed aqueous-phase reforming of glycerol through tailored platinum nanoparticles

    Article • Applied Catalysis B Environment and Energy, December 2018, Elsevier

    Dr. Arunabhiram Chutia

  21. The electronic properties of Au clusters on CeO2 (110) surface with and without O-defects

    Article • Faraday Discussions, January 2018, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  22. Theory as a driving force to understand reactions on nanoparticles: general discussion

    Article • Faraday Discussions, January 2018, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  23. Tandem Site- and Size-Controlled Pd Nanoparticles for the Directed Hydrogenation of Furfural

    Article • ACS Catalysis, February 2017, American Chemical Society (ACS)

    Dr. Arunabhiram Chutia

  24. The adsorption of Cu on the CeO2(110) surface

    Article • Physical Chemistry Chemical Physics, January 2017, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  25. Quantum and Statistical Mechanical Simulations for Porous Catalyst Modelling

    Article • November 2016, World Scientific Pub Co Pte Lt

    Dr. Arunabhiram Chutia

  26. Adsorption of formate species on Cu( h , k , l ) low index surfaces

    Article • Surface Science, November 2016, Elsevier

    Dr. Arunabhiram Chutia

  27. The reaction of formic acid with Raney TM copper

    Article • Proceedings of the Royal Society A Mathematical Physical and Engineering Sciences, April 2016, Royal Society Publishing

    Stewart Parker, Dr. Arunabhiram Chutia

  28. Towards microfluidic reactors for in situ synchrotron infrared studies

    Article • Review of Scientific Instruments, February 2016, American Institute of Physics

    David Nelson, Dr. Arunabhiram Chutia

  29. Room temperature methoxylation in zeolites: insight into a key step of the methanol-to-hydrocarbons process

    Article • Chemical Communications, January 2016, Royal Society of Chemistry

    Dr. Arunabhiram Chutia

  30. Design and control of Lewis acid sites in Sn-substituted microporous architectures

    Article • Journal of Materials Chemistry A, January 2016, Royal Society of Chemistry

    Professor Andrew M Beale, Dr. Arunabhiram Chutia

  31. Restructuring of AuPd Nanoparticles Studied by a Combined XAFS/DRIFTS Approach

    Article • Chemistry of Materials, May 2015, American Chemical Society (ACS)

    Professor Andrew M Beale, Dr. Arunabhiram Chutia

  32. Electrochemical synthesis and characterization of stable colloidal suspension of graphene using two-electrode cell system

    Article • January 2015, American Institute of Physics

    Dr. Arunabhiram Chutia

  33. A theoretical insight on the interaction between Pt nanoparticles and hydroxylated graphene nanoflakes

    Article • Surface Science, October 2014, Elsevier

    Dr. Arunabhiram Chutia

  34. Optimised photocatalytic hydrogen production using core–shell AuPd promoters with controlled shell thickness

    Article • Physical Chemistry Chemical Physics, January 2014, Royal Society of Chemistry

    Dr Ren Su, Dr. Arunabhiram Chutia, Dr David J Morgan

  35. Role of lone pair and π-orbital interaction in formation of water nanostructures confined in carbon nanotubes

    Article • Chemical Physics Letters, October 2012, Elsevier

    Dr. Arunabhiram Chutia

  36. Orbital interaction and local stability of Ni substituted Pd nanoalloys

    Article • Chemical Physics Letters, October 2011, Elsevier

    Dr. Arunabhiram Chutia

  37. Local electronic and electrical properties of functionalized graphene nano flakes

    Article • Physica B Condensed Matter, April 2011, Elsevier

    Dr. Arunabhiram Chutia

  38. Influence of surface chemistry on the electronic properties of graphene nanoflakes

    Article • Chemical Physics Letters, February 2011, Elsevier

    Dr. Arunabhiram Chutia

  39. Enhanced gas-sensing behaviour of Ru-doped SnO2 surface: A periodic density functional approach

    Article • Journal of Physics and Chemistry of Solids, September 2009, Elsevier

    Dr. Arunabhiram Chutia

  40. An electrical conductivity prediction simulator based on TB-QCMD and KMC. System development and applications

    Article • Journal of Molecular Structure THEOCHEM, June 2009, Elsevier

    Dr. Arunabhiram Chutia

  41. Development of a Multi-Scale Electromigration Simulator Based on a Combination of Ultra Accelerated Quantum Chemical Molecular Dynamics and Kinetic Monte Carlo Methods Application to Cu Interconnects Lifetime Simulation

    Article • Japanese Journal of Applied Physics, April 2009, Institute of Physics Publishing

    Dr. Arunabhiram Chutia

  42. Theoretical Study on Electronic and Electrical Properties of Nanostructural ZnO

    Article • Japanese Journal of Applied Physics, April 2008, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  43. Development of A Seebeck Coefficient Prediction Simulator Using Tight-Binding Quantum Chemical Molecular Dynamics

    Article • Japanese Journal of Applied Physics, April 2008, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  44. Influence of Organic Functional Groups on the Electrical Properties of Carbon Black: A Theoretical Study

    Article • Japanese Journal of Applied Physics, April 2008, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  45. Development of a Thermal Conductivity Prediction Simulators Based on the Effects of Electron Conduction and Lattice Vibration

    Article • Japanese Journal of Applied Physics, April 2007, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  46. Theoretical Investigation on Electrical and Electronic Properties of Carbon Materials

    Article • Japanese Journal of Applied Physics, April 2007, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  47. Theoretical Simulation of Dielectric Breakdown by Molecular Dynamics and Tight-Binding Quantum Chemistry Methods

    Article • Japanese Journal of Applied Physics, April 2007, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  48. Development of a Seebeck Coefficient Prediction Simulator Using Tight-Binding Quantum Chemical Molecular Dynamics

    Article • January 2007, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  49. Theoretical Study on Electronic and Electrical Properties of Nano Structural ZnO

    Article • January 2007, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  50. Theoretical Investigation of Electrical and Electronic Properties of Carbon Materials

    Article • January 2006, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia

  51. Theoretical Simulation of Dielectric Breakdown by Molecular Dynamics and Tight-Binding Quantum Chemistry Methods

    Article • January 2006, Japan Society of Applied Physics

    Dr. Arunabhiram Chutia