Publications

1-Nature Materials, 2-PNAS, 2-JACS, 5-ACS Energy Letters, 4-ACS Nano, 4-Physical Review B, 4-AngewChem, 1-Advanced Materials, 4-Advanced Functional Materials, 1-Materials Today, 18-J.Mater.Chem.A, 8-Chem.Mater., 12-ACS Appl.Mater.Interfaces, 2-ACS Catalysis, 6-Small, 4-Nano Energy, 2-Nanoscale, 3-J.Mater.Chem.C, 9-ACS Applied Energy Materials, 1-Solar RRL, 1-Chem.Sci., 4-Inorg.Chem., 7-J.Phys.Chem.Letters, 11-J.Phys.Chem.C, 7-PCCP, 4-Applied Physics Letters, 3-APL Materials, 1-Physical Review Materials, 1-Applied Physics Reviews

Published Articles =203, Citations >8500, h-index =51, Impact >1600

2026

  1. Harmonizing Symmetry and Spin: Unveiling Giant Rashba Splitting and Diverse Topological Phases in Composite Quantum Materials

    A. Sarangi, R. Sarkar, Sudip Chakraborty* - Under Review
  2. Local Symmetry Driven Octahedral Distortions, Phonon Mode Softening and Band Inversion in Pressure Tuned Oxide Double Perovskite

    Manasa G.B., A. Sarangi, Sudip Chakraborty* - Under Review
  3. Rashba Splitting Induced Catalytic Activity Enhancement in Bismuth Based 2D Hexagonal Monolayers

    A. Rawat, Sudip Chakraborty* - Under Review
  4. Manipulating Wannier-Mott Inter-layer Exciton, Radiative Lifetime and Rashba Spin Splitting in Sb-based Chalcogenide Janus Monolayers

    D. Kumar, Sudip Chakraborty* - Under Revision
  5. Tuning of Excitonic Radiative Lifetime and Rashba Spin Texture in Lead-free quasi-2D Hybrid Perovskites

    J. Kaur, Sudip Chakraborty* - Under Revision
  6. Many Body Perturbation Theory based Probing of Inter/Intralayer Exciton Delocalization in Indium Based Chalcogenide Heterostructures

    Ponnappa K.P., Sudip Chakraborty* - Under Revision
  7. Rashba Spin Splitting and Photocatalytic Activity in 2D Janus SbXBr(X=S, Se) Monolayers based Van der Waals Heterostructure

    D Kumar, Sudip Chakraborty* - Revision Submitted
  8. Tuning Catalytic Activity in Nitride Perovskite Through Strain Induced Rashba Spin Splitting Manipulation

    P. Mohanty, S. Mir, R. Ahuja*, Sudip Chakraborty*, Chem.Mater- Accepted(2026)
  9. Pressure Driven Interplay of Rashba, Rashba-Dresselhaus and Persistent Spin Texture in Lead-free Quasi-2D Hybrid Perovskites

    J. Kaur, Sudip Chakraborty*,J.Mater.Chem.A -Accepted(2026)
  10. Strain Modulated Tuning of Rashba Signature and Catalytic Activity on Oxynitride Surface: Facet Matters

    P. Mohanty, R. Ahuja, Sudip Chakraborty*, ACS Appl.Mater.Interfaces - Accepted(2026)
  11. Exciton Delocalization and Excitonic Radiative Lifetime in Ternary Rhodium Halide Perovskites under Lattice Compression

    J. Kaur, Sudip Chakraborty*, J.Phys.Chem.C -Accepted(2026)
  12. Controlled Templated Growth of Low-Dimensional Perovskite for Improved Interfacial Electronic Coupling and Passivation in Wide Bandgap Perovskite Solar Cells

    D.Gupta, P. Srivastava, P. Paul, B. Bhardwaj, K. Hossain, J. Aji, P. Srinivasan, Laxmi, Sudip Chakraborty*, D. Kabra*, ACS Appl.Mater.Interfaces - Accepted(2026)
  13. Silver Single Atom in Polymeric Carbon Nitride as a Stable and Selective Oxygen Reduction Electrocatalyst towards Hydrogen Peroxide Synthesis

    A. Gupta, M. Shanmugasundaram, S. K. Sharma, Sudip Chakraborty, D. Zitoun, J.Mater.Chem. A - Accepted(2026)
  14. Fe2+- Induced activation of Single and Dual Metal Site - Lattice Oxygen Mechanism in Fe rich NiFe-LDHs for Oxygen Evolution Reaction

    N. Dharmarajan, M. Fawaz, V. Parey, Sudip Chakraborty, C. Sathish, T. Tran, X. Ta, S. Talapaneni, Z. Li, K. Ramadass, A. Tricoli, J.H Yang, A. Vinu, Advanced Science – Accepted(2026).
  15. Trap-Engineered Deep Ultraviolet and NIR Persistent Bi-Activated Phosphor: Luminescence Tailoring via Secondary Cations Substitution in Garnet Framework

    A. Balhara, S. Sharma, J. Yadav, Sudip Chakraborty, A. Sagdeo, A. Pathak, K. Sudarshan, G. Patra, J. Panda N. Rawat, S. Gupta, ACS Appl.Mater.Interfaces, 18, 8459(2026).

    16. 2025

    1. Pressure induced evolution of anisotropic superconductivity and Fermi surface nesting in a ternary boride

      S. Pramanick, Sudip Chakraborty, Arghya Taraphder, Physical Review B, 112, 214517(2025)
    2. Effect of temperature and electric field on interfacial charge transfer and bandedge alignment in MXene-halide perovskite heterostructures

      A. Sarangi, Manasa G.B., Sudip Chakraborty*, Physical Review B, 112, 235306(2025)
    3. Impact of strain on excitonic radiative lifetime in a polar Hf3ZrS8 monolayer: Theoretical insight based on many-body perturbation theory

      D. Kumar, Sudip Chakraborty*, Physical Review B, 112, 125107(2025)
    4. Interfacial Configuration Impact on Rashba Spin Splitting, Excitonic Radiative Lifetime and Band Edge Alignment in Janus Monolayers based Heterostructures

      Ponnappa K.P., S. Bhattacharya, Sudip Chakraborty*, J.Mater.Chem. A, 13, 32232(2025)
    5. Crossover of Frenkel and Wannier-Mott Excitons through Halide Composition Tuning in Mixed Halide Perovskites

      J. Kaur, Sudip Chakraborty*, Small, 21, 2408919(2025)
    6. Emerging Chalcogenides based van der Waals Heterostructures for Ultrathin Excitonic Solar Cells with enhanced Photo-conversion Efficiency

      Ponnappa K.P., Sudip Chakraborty*, J.Mater.Chem. A, 13, 7949(2025)
    7. Three-fold Impact on Reaction Coordinate Mapping of Zirconium based Tri-chalcogenide Pseudo-monolayers as Emerging Ultrathin Catalysts for Water Splitting

      Ponnappa K. P.,Sudip Chakraborty*, Advanced Theory & Simulations, 8, 2400816(2025).
    8. Tuning Electronic and Optical Properties of 2D/3D Interfaces of Hybrid Perovskites through Interfacial Charge Transfer: Prediction of Higher Efficiency Interface Solar Cells using hybrid-DFT methods

      H. Banerjee*, M.K. Nazeeruddin, Sudip Chakraborty*, ACS Appl.Mater.Interfaces, 17, 19701(2025)
    9. Charge Transfer and Reaction Coordinate Construction based Theoretical Investigation of eNRR and HER on Cuboidal silver phosphate: A Tale of Two Competing Mechanisms

      P. Mohanty, Tisita Das, R. Ahuja*, Sudip Chakraborty*, Sustainable Energy Fuels, 9, 2333(2025)
    10. Emerging van der Waals Hetero-structures for Enhanced Photocatalytic Water Splitting Through Type-II Band Alignment

      S. Tomar, Sudip Chakraborty*, J.Phys.Chem. C, 129, 6177(2025)
    11. Ordered mesoporous borocarbonitride-reduced graphene oxide heterostructure for quasi solid-state supercapacitors and sodium-ion batteries

      R. Bahadur, S. Deshpande, B. Singh, N.George, P.Aleena, W. Li, DC. Qi, R. Srivastav,Sudip Chakraborty, A. Vinu, Nano Energy, 146, 111495(2025)
    12. MXenes as Bipolar Transport Layer on the Performance of SnS-based Piezophototronic Photodetector

      G. Polumati, A. Thakur, Tisita Das, C. Kolli, S. Siraj, S. Yadav, Sudip Chakraborty, Babak Anasori, P. Sahatiya, npj 2D Materials and Applications, 9, 101(2025)
    13. Microporous Architecture of Boron Carbon Nitride with Anomalous Performance for Supercapacitor and Oxygen Reduction Reaction

      C. Sathish, S. Deshpande, M. Fawaz, A. Ruban, J. Qu, R. Zheng, Sudip Chakraborty, J. Yi, A. Vinu, Small, 21, 11178(2025)
    14. Probing Sulphur-Mediated Surface Dynamics in Oxomolybdate Nano-rods toward Efficient Oxygen Evolution

      A. Satheesan, V. Parey, A. Karmakar, R. Madhu, S. Nagappan, S.S. Roy, P. Mazumder, R. Thangamuthu*, Sudip Chakraborty*, S. Kundu*, Small, 21, 08560(2025)
    15. Hierarchical 3D-nanoflower LDHs Heterojunction: A Bifunctional Electrocatalyst for Total Water Splitting

      H. Dhandapani, R. Karthikeyan, V. Parey, K. Senthivel, Sudip Chakraborty*, R. Balakrishnan, S. Kundu*, J.Mater.Chem. A, 13,39928(2025)
    16. Synergistic Mitigation of Phase Segregation and Blinking Suppression along with Enhanced Electrocatalytic Activity in CsPbBrI2 Perovskite Nanocrystals via Ascorbic Acid Surface Treatment

      S. Biswas, M.K. Panda,S. Chatterjee, J. Satra, S.K. Sharma, J. Rath, A. Dutta, D. Acharjee, Sudip Chakraborty, S. Ghosh, N. Mishra, Advanced Functional Materials, 2505506(2025)
    17. Unlocking Brightness in CsPbCl3 Perovskite Nanocrystals: Screening Ligands and Metal Halides for Effective Deep Trap Passivation

      N Fiuza-Maneiro, J Ye, S Sharma, Sudip Chakraborty*, S Gomez-Gana,R.L.Z. Hoye, L. Polavarapu*, ACS Energy Letters, 10, 1623(2025)
    18. Chemical strain induced Rashba effect in two-dimensional Ruddlesden-Popper perovskites

      Suhas K. T., Tisita Das, A. Singh, A. Khadiev, A. Soni, Sudip Chakraborty, R.Viswanatha, Physical Review B (Letter), 118, L081401(2025)
    19. Exciton-Polaron in a quasi-one-dimensional chain of hexyl-diammonium-BiI5 Octahedra

      D. Tomar, S. Deshpande, S. Gupta, Sudip Chakraborty*, P. Nayak*, J. Dasgupta*, J.Phys.Chem. Lett. 16, 191(2025)
    20. Dynamic Strain-Engineered Au-Ag Alloy Nano-Seed Network for Enhanced Electrochemical Oxygen Reduction and High-Performance Alkaline Membrane H2 Air Fuel Cells

      S. Mondal, S. Deshpande, S. De, T. Ghosh, Y. Kharwar, S. Patra, B. Karmakar, A. Dutta, Sudip Chakraborty, D. Senapati, Small, 21, 2500555(2025)
    21. Fabrication of Cu2NiSnS4 Nanoparticles on CdS with a Computationally Predicted Low Lattice Mismatch for Photo-Electrochemical Hydrogen Evolution

      D. Nilegave, A. Sarangi, S. Rondiya, G. Shaikh, M. Nasane, S. Jathar, S. Barma, K. Kore, S.V. Ghaisas,Sudip Chakraborty*, A. Funde*, ACS Applied Nano Materials, 8, 1628(2025)

    2024

    1. Metal nanoclusters for interface engineering and improved photovoltaic performance in organic solar cells

      Y. Alishan, A. Joseph; A. Pillai, R. Aparna, R. Sarkar, Sudip Chakraborty*, S. Mandal*, M. Namboothiry*, ACS Nano, 18, 35383(2024)
    2. Effect of pre-intercalation on Li-ion diffusion mapped by topochemical single-crystal transformation and operando investigation

      Y. Luo+, J. Handy+, Tisita Das+, J.Ponis+, R. Albers, Y. Chiang, M. Pharr, B. Schultz, L. Gobbato, D. Brown, Sudip Chakraborty*, Sarbajit Banerjee*, Nature Materials, 23, 960(2024) [+=equal contributing first author]
    3. Spin Texture Evolution of Rashba Splitting under Pressure: A Case Study of Inorganic Nitride Perovskite

      S. H. Mir, Sudip Chakraborty*, J.Mater.Chem. A, 12, 29196(2024)
    4. Zirconium dichalcogenides based van der Waals Heterostructures for Efficient Schottky Barrier Solar Cells

      L. Tatikondewar, Sudip Chakraborty*, R. Ahuja, A. Kshirsagar*, ACS Applied Energy Materials, 7, 5071(2024).
    5. Thermally-Induced Reversible Fluorochromism by Self-Trapped Excitonic Emission in a Two-Dimensional Hybrid Copper(I)-Halide Single Crystal

      A. Dev, Manasa G.B., S. Deshpande, P. Mukherjee, A. Ajayakumar, C. Muthu, T. Okamoto,Sudip Chakraborty*, D. D. Sarma, V. Biju, C. Vijayakumar*, Chem.Mater. 36, 5912(2024).
    6. Unravelling Rashba effect through spin-texture evolution in uni-dimensional halide-perovskite under compression

      J. Kaur, Sudip Chakraborty*, Physical Review Materials, 8, 055405(2024)
    7. Establishing the Correlation between Rashba Spin Splitting and HER Activity Enhancement in Janus Structures

      D. Kumar, Sudip Chakraborty*, J.Mater.Chem. A, 12, 10287(2024)
    8. Ultrasmall CsPbBr3 Blue Emissive Perovskite Quantum Dots Using K-Alloyed Cs4PbBr6 Nanocrystals as Precursors

      C Otero-Martínez, M Zaffalon, Y Ivanov, N Livakas, L Goldoni, G Divitin, Sankalpa Bora, G. Saleh, F. Meinard, A. Fratelli, Sudip Chakraborty, L.Polavarapu, S. Brovelli, Liberato Manna, ACS Energy Letters, 9, 2367(2024)
    9. Colloidal Aziridinium Lead Bromide Quantum Dots

      Maryna I. Bodnarchuk, L. Feld, C. Zhu, S. Boehme, F. Bertolotti, J. Avaro, M. Aebli, S. Mir, N. Masciocchi, R. Erni, Sudip Chakraborty, A. Guagliardi, G. Raino, Maksym V. Kovalenko, ACS Nano, 18, 5684(2024)
    10. High-Performance One-Dimensional Halide Perovskite Crossbar Memristors and Synapses for Neuromorphic Computing

      S. Vishwanath, B. Febriansyah, S. Ng, Tisita Das, J. Acharya, R. John, D. Sharma, P. Danajaya, M. Jagadeeswararo, N. Tiwari, M. Kulkarni, W. Lew, Sudip Chakraborty*, A. Basu, N. Mathews*, Materials Horizon, 11, 2643(2024)
    11. Sulfoxide-Functional Nanoarchitectonics of Mesoporous Sulfur-Doped C3N5 for Photocatalytic Hydrogen Evolution,

      X. Guan, X Zhang, Z Li, S Deshpande, M Fawaz, N Dharmarajan, C Lin, Z. Lei, L. Hu, J-K. Huang, P. Kumar, Z. Sun,Sudip Chakraborty, A. Vinu, Chem.Mater. 36, 4511(2024)
    12. Improved Alcohol Oxidation through Combined Effects of Tensile Lattice Strain and Twin Defects in Core–Shell Electrocatalysts,

      T. Singha, S. Tomar, Sudip Chakraborty, S. Das, B. Satpati, Small, 20, 2309736(2024)
    13. Incorporation of Bimetallic Sulfide with Carbon Nitride for Advanced Na-Ion Batteries,

      J. Lee, R. Bahadur, S. H. Mir, I. Bargoria, V. Perumalsamy, A. Ruban, X. Yu, M. Breese, J. Yi, Sudip Chakraborty*, A. Vinu*, Small, 20, 234587(2024)
    14. Zero-dimensional Tin Halide Perovskite with Long Charge Carrier Lifetime and Anisotropic Photoconductivity for Selective Deep-UV Photodetection

      A. Ajayakumar, C. Muthu, Manasa G. B., A. Dev, R. Nshikubo, Sudip Chakraborty*, A. Saeki, L.Dou, V. Nair*, Advanced Functional Materials, 34, 2304899(2024)
    15. Ultra-Low Loaded Platinum Bonded Hexagonal Boron Nitride as Stable Electrocatalyst for Hydrogen Generations

      R. Sadhukhan, A. Kumar, Ponnappa K. P., A. Guha, R. Arenal, Sudip Chakraborty, T.N. Narayanan, ACS Appl.Mater.Interfaces, 16, 8627(2024)
    16. Catching an Oxo Vanadate Porous Acetylacetonate Covalent Adaptive Catalytic Network that Renders Mustard-Gas Simulant Harmless

      N. Das, R. Paul, S. Tomar, C. Biswas, Sudip Chakraborty*, J. Mondal*, Inorg.Chem., 63, 6092(2024)
    17. Tuning Optoelectronic Properties of KBaTeBiO6 Double Perovskite through Cationic Interplay

      Manasa G.B, Sudip Chakraborty*, ACS Applied Optical Materials, 2, 254(2024)

2023

  1. Augmenting Bi-functional Catalytic Efficiency in Vanadium based Pseudo-monolayer: Chemical Paradigm of Functionalization, Vacancy and External Stimuli

    D. Kumar, Sudip Chakraborty*, Int. J. Hydrogen Energy, 51, 323(2023)
  2. Pressure Driven Band Gap Narrowing in Rb2AgPdCl5: Towards Shockley–Queisser limit of Lead Free Double Perovskite

    S. Mir, Sudip Chakraborty*, J.Phys.Chem. C, 127, 19728(2023)
  3. Chalcogen Composition Driven Enhancement of Catalytic Efficiency in Zirconium based Monolayers: Insight from Reaction Coordinate Mapping,

    S. Tomar, Sudip Chakraborty*, Sustainable Energy Fuels, 7, 4668(2023)
  4. Pressure Driven Optical Transitions in Non-toxic Double Perovskite with a Columnar-ordered B-Site Cation: Piezochromism without Phase Transformation

    S. Mir, Sudip Chakraborty*, J.Phys.Chem. C, 127, 14805(2023)
  5. CsPbCl3→CsPbI3 Exchange in Perovskite Nanocrystals Proceeds Through a Jump-the-Gap Reaction Mechanism

    N Livakas, S Toso, Y Ivanov, Tisita Das, Sudip Chakraborty, G Divitini, Liberato Manna, JACS, 145, 20442(2023)
  6. A Universal Strategy of Perovskite Ink-Substrate Interaction to Overcome the Poor Wettability of a Self-Assembled Monolayer for Reproducible Perovskite Solar Cells

    A. Kulkarni, R. Sarkar, S. Akel, M. Haeser, B. Klingebiel, M. Wuttig, S. Weigand, Sudip Chakraborty*, M. Saliba*, T. Kirchartz*, Advanced Functional Materials, 33, 2305812(2023)
  7. Defects Tune the Strong Metal-Support Interactions in Copper Supported on Defected Titanium Dioxide Catalyst for CO2 Reduction

    R. Belgamwar, R. Verma, Tisita Das, Sudip Chakraborty, P. Sarawade, V. Polshettiwar, JACS, 145, 8634(2023)
  8. Self-powered NH3 synthesis by trifunctional Co2B based high power density Zn-air batteries

    D. Gupta, A. Kafle, P. Mohanty, Tisita Das, Sudip Chakraborty, R. Ahuja, T. Nagaiah, J.Mater.Chem. A, 11, 12223(2023)
  9. Combining π‑Conjugation and Cation−π Interaction for Water-Stable and Photoconductive One-Dimensional Hybrid Lead Bromide

    T. Sheikh, G. Anilkumar, Tisita Das, A. Rahman, Sudip Chakraborty*, Angshuman Nag*, J.Phys.Chem. Lett. 114, 1870(2023)
  10. S-doped C3N5 derived from thiadiazole for efficient photocatalytic hydrogen evolution

    X. Guan, M. Fawaz, R. Sarkar, C. Lin, Z. Li, Z. Lei, N. Dharmarajan, P. Kumar, X. Zhang, J. Yang, L. Hu, T. Wu, Sudip Chakraborty, J. Yi, A. Vinu, J.Mater.Chem. A, 11, 12837(2023)
  11. Pt nanoparticles sensitized vertical aligned large area MoS2 flakes for enhanced and selective H2 sensing at room temperature

    R. Wadhwa, A. Kumar, R. Sarkar, P. Mohanty, D. Kumar, S. Deswal, P. Kumar, R. Ahuja, Sudip Chakraborty, M Kumar, ACS Applied Nano Materials, 6, 2527(2023)
  12. Zinc Substituted Cobalt Phosphate [ZnCo2(PO4)2] as a Bifunctional Electrocatalyst

    D. Singh, S. Singh, Ponnappa K. P., R. Rai, P. Chirawatkul, Sudip Chakraborty, M. Fichtner, P. Barpanda, Inorg.Chem. 62, 12345(2023)
  13. Conformational Disorder in a Hybrid 2D Perovskite with a Long Aliphatic Chain under Pressure

    Y Lekina, D Bradley, Y Xiao, A Thanetchaiyakup, X Zhao, J Kaur, Sudip Chakraborty, H. Soo, J. Hanna, Shen, Ze Xiang, J.Phys.Chem. C, 127, 16496(2023)
  14. Efficient CO2 utilization and sustainable energy conversion via aqueous Zn-CO2 batteries

    S. Kaur, M. Kumar, D. Gupta, P. Mohanty, Tisita Das, Sudip Chakraborty, R. Ahuja, T. Nagaiah, Nano Energy, 109, 108242(2023)
  15. Unveiling and Understanding the Remarkable Enhancement in the Catalytic Activity by the Defect Creation in UIO-66 during the Catalytic Transfer Hydrodeoxygenation of Vanillin with Isopropanol

    A. Kar, R. Sarkar, A. Manal, R. Kumar, Sudip Chakraborty*, R. Ahuja, R. Srivastava*, Applied Catalysis B, 325, 122385(2023)
  16. Vacancy Fused Multiple Layers of Copper Sulfoselenide Superstructures: A Propitious HER Electrocatalyst in Acid

    S. Kumaravel, D. Kumar, S. Sankar, A. Karmakar, R. Madhu, K. Bera, H. Dhandapani, S. Nagappan, Sudip Chakraborty*, S. Kundu*, Catal. Sci. Technol., 13, 694(2023)

2022

  1. Complementary Effects of Functionalization, Vacancy Defects and Strain Engineering in activating the basal plane of monolayer FePS3 for HER

    Tisita Das, Sudip Chakraborty, P. Sen, Sustainable Energy Fuels, 6, 5621(2022)
  2. Tuning Paradigm of External Stimuli Driven Electronic, Optical and Magnetic Properties in Hybrid Perovskites and Metal Organic Complexes

    H. Banerjee, J. Kaur, M. K. Nazeeruddin*, Sudip Chakraborty*, Materials Today, 60, 183(2022)
  3. Rationalization of Double Perovskite Oxides as Energy Materials: A Theoretical Insight from Electronic and Optical Properties

    Manasa G. B., Sudip Chakraborty*, ACS Materials Au, 2, 655(2022) [Invited Perspective for Rising Stars in ACS Materials Au Special Issue]
  4. Single Atom Functionalization in Vanadium Dichalcogenide Monolayers: Towards Enhanced Electrocatalytic Activity

    S. Tomar, P. Sen, Sudip Chakraborty*, Sustainable Energy Fuels, 6, 5337(2022)
  5. Vanadium Dioxide-based Miniaturised Thermal Sensors: Humidity Effects on Phase Change and Sensitivity
    P. Elango, S. Kabir, Ponnappa K. P., M. Low, M. Yang, Sudip Chakraborty, S. Walia, S. Sriram, M. Bhaskaran, ACS Applied Electronic Materials, 4, 5456(2022)
  6. Diffusion mediated morphological transformation in bifunctional Mn2O3/CuO-(VO)3(PO4)2.6H2O for enhanced electrochemical water splitting

    S. Bhowmick, A. Sarangi, C. Moi, Sudip Chakraborty, M. Qureshi, ACS Appl.Mater.Interfaces, 14, 52204(2022)
  7. Assessing the Drawbacks and Benefits of Ion migration in Lead Halide Perovskites

    K. Sakhatskyi, R. John, A. Guerrero, S. Tsarev, S. Sabisch, Tisita Das, G. Matt, S.Yakunin, I.Cherniukh, M.Kotyrba, Y. Berezovska, M. Bodnarchuk, Sudip Chakraborty, J. Bisquert, Maksym Kovalenko, ACS Energy Letters, 7, 3401(2022) [Editor's Choice Featured Article]
  8. High yield selective electrochemical conversion of N2 to NH3 via morphology controlled silver phosphate under ambient conditions

    D. Gupta, A. Kafle, S. Kaur, P. Mohanty, Tisita Das, Sudip Chakraborty, R. Ahuja, T. Nagaiah, J.Mater.Chem. A, 10, 20616(2022)
  9. Nanocoral Architecture for Enhanced Hydrazine Assisted Water Oxidation: Insight from Experiment and Theory

    N Sethulakshmi, S. Nellaiappan, Ponnappa K.P., Tisita Das, S. Irusta, Sudip Chakraborty*, S. Sharma*, Journal of Electroanalytical Chemistry, 922, 116776(2022)
  10. Morphology Tuned Pt3Ge Accelerates Water Dissociation to Industrial Standard Hydrogen Production over a wide pH Range,

    S. Mondal, S. Sarkar, D. Bagchi, Tisita Das, R. Das, A. Singh, Ponnappa K.P., C. Vinod, Sudip Chakraborty, Sebastian Peter, Advanced Materials, 34, 2202294(2022)
  11. Facile Synthesis and Phase Stability of Cu-based Na2Cu(SO4)2.xH2O (x=0-2) Sulfate Minerals as Conversion type Battery Electrodes

    S. Singh, A. Neveu, K. Jayanthi, Tisita Das, Sudip Chakraborty, A. Navrotsky, V. Pralong, P. Barpanda, Dalton Trans. 51, 11169(2022)
  12. Tuning the electronic structure of Ni vacancy enriched AuNi spherical nanoalloy via electrochemical etching for water oxidation study in alkaline and neutral medium

    A. Karmakar, Tisita Das, K. Karthick, S. Kumaravel, S. Sankar, R. Madhu, Sudip Chakraborty*, S. Kundu*, Inorg.Chem. 21, 8570(2022)
  13. Incorporating Au11Nanocluster on MoS2 Nanosheet Edges for Promoting Hydrogen Evolution Reaction at the Interface

    S. Gratious, A. Karmakar, D. Kumar, S. Kundu, Sudip Chakraborty, S. Mandal, Nanoscale, 14, 7919(2022)
  14. Theory abide experimental investigations on morphology driven enhancement of electrochemical energy storage performance for manganese titanate perovskites electrodes

    N. Kitchamsetti, M. Samtham, P. Didwal, D. Kumar, D. Singh, S. Bimli, P. Chikatea, D. Bashaa, S. Kumar, C. Park; Sudip Chakraborty*; R. Devan*, Journal Power Sources, 538, 231525(2022)
  15. Epitaxial growth of GaAs nanowires on synthetic mica by metal-organic chemical vapor deposition

    A. Gopakumar, Ponnappa. K. P., X.Yuan, Z. Azimi, F. Kremer, Chennupati Jagadish, Sudip Chakraborty*, Hark Tan*, ACS Appl.Mater.Interfaces, 14, 3395(2022)
  16. N, H Dual-doped Black Anatase TiO2 Thin Films towards Significant Self-Activation in Electrocatalytic Hydrogen Evolution Reaction in Alkaline Media

    S. Parmar, Tisita Das, B. Ray, B. Debnath, S. Gosavi, G. Shanker, S. Datar*, Sudip Chakraborty*, S.B. Ogale* Adv. Energy Sustainability Res. 3, 2100137(2022)
  17. Probing Photoexcited Charge Carrier Trapping and Defect Formation in Synergistic Doping of SrTiO3

    N. Koshi, D. Murthy, Sudip Chakraborty, S. C. Lee, S. Bhattacharjee, ACS Applied Energy Materials, 1, 1159(2022)
  18. Tuning Spin Texture and Spectroscopic Limited Maximum Efficiency through Chemical Composition Space in Double Halide Perovskites

    J. Kaur, Sudip Chakraborty*, ACS Applied Energy Materials, 5, 5579(2022)
  19. Progress and Challenges in Layered Two-dimensional Hybrid Perovskites

    P. Mohanty, R. Ahuja, Sudip Chakraborty*, Nanotechnology, 33, 292501(2022) [Invited Perspective Article]
  20. Tuning Composition Space in Lead-Free Divalent and Tetravalent Halide Perovskites:A Critical Review

    A. Sarangi, Manasa G.B., Sudip Chakraborty*, Emergent Materials, 5, 1021(2022) [Invited Review Article]

2021

  1. Evolution of Hybrid Organic-Inorganic Perovskite Materials under External Pressure

    Manasa G. B., M. K. Nazeeruddin*, Sudip Chakraborty*, Applied Physics Reviews, 8, 041409(2021) [Editor's Choice Featured Article]
  2. The Status Quo of Rashba Phenomena in Hybrid Perovskite Materials

    Sudip Chakraborty*, M. K. Nazeeruddin*, J.Phys.Chem. Lett. 12, 361(2021)
  3. Recent Advancements in Non-toxic Halide Perovskites: Beyond Divalent Composition Space

    D. Kumar†, J. Kaur†, P. Mohanty, R. Ahuja*, Sudip Chakraborty*, ACS Omega, 6, 33240(2021). [Invited Perspective Article]. [†=equal contributing first author]
  4. An Organic-Inorganic Perovskitoid with Zwitterion Cysteamine Linker and Its Crystal-Crystal Transformation to Ruddlesden-Popper Phase

    P. Kour, M. Reddy, S. Pal, S. Sidhik, Tisita Das, P. Pandey, S. Mukherjee*, Sudip Chakraborty*, A. D. Mohite*, S. B. Ogale, Angewandte Chemie, 60, 18750(2021)
  5. Self-Assembled Organic Cations Assisted Band-Edge Tailoring in Bismuth based Perovskites for Enhanced Visible Light Absorption Photoconductivity

    J. Pious, Manasa G. B., C. Muthu, R. Nishikubo, A. Saeki, Sudip Chakraborty*, A. Takai, M. Takeuchi, V.C. Nair*, J.Phys.Chem. Lett., 12, 5758(2021)
  6. Concerted Ion-Migration and Diffusion Induced Degradation in Lead-Free Ag3BiI6 Rudorffite Solar Cells under Ambient Conditions

    A. Kulkarni, F. Ünlü, N. Pant, J. Kaur, C. Bohr, A. K. Jena, S. Öz, M. Yanagida, Y. Shirai, M. Ikegami, K. Miyano, Y. Tachibana, Sudip Chakraborty, Sanjay Mathur, Tsutomu Miyasaka, Solar RRL, 5, 2100077(2021)
  7. Halide Replacement with Complete Preservation of Crystal Lattice in Mixed-Anion Lanthanide Oxyhalides

    M. Udayakantha, J. Handy, R. Davidson, J. Kaur, G. Villalpando, L. Zuin, Sudip Chakraborty, Sarbajit Banerjee, Angewandte Chemie, 60, 15582(2021)
  8. Structure Tailored Non-Noble Metal based Ternary Chalcogenide Nanocrystals for Pt-like Electrocatalytic Hydrogen Production

    S Sarkar, A Rawat, Tisita Das, M Gaboardi, Sudip Chakraborty, C. Vinod, S. Peter, ChemSusChem, 14, 3074(2021)
  9. Local electrocatalytic activity of PtRu supported on nitrogen doped carbon nanotubes towards methanol oxidation by scanning electrochemical microscopy

    D. Gupta, Sudip Chakraborty, R. Amorim, R. Ahuja, T. Nagaih, J.Mater.Chem. A, 9, 21291(2021)
  10. Identifying the catalytically active sites on the layered tri-chalcogenide compounds CoPS3 and NiPS3 for efficient hydrogen evolution reaction

    K. Alam, Tisita Das, Sudip Chakraborty, P. Sen, PhysChemChemPhys, 23, 23967(2021).
  11. Probing active sites on MnPSe3 and FePSe3 tri-chalcogenides as a design strategy for better hydrogen evolution reaction catalyst

    Tisita Das, K. Alam, Sudip Chakraborty, P. Sen, Int.J. Hydrogen Energy, 46, 37928(2021)
  12. Recent Progress in Al-, K-, and Zn-Ion Batteries: Experimental and Theoretical Viewpoints

    D. Pal, Sudip Chakraborty*, S. Chattopadhyay*, Energy Technology,9, 2100382(2021) [Invited Review Article]
  13. Probing defects and their implications in pH-controlled ZnO QDs: A theory aided experimental investigation,

    P. Mishra, M. Kumar, J. Kaur, A. Gaurav, D. Sinha, Sudip Chakraborty, S. Sen, J. Mater. Science, 32, 27084(2021)
  14. Lithium Silicates Nanosheets with Excellent Capture Capacity and Kinetics with Unprecedented Stability for High-Temperature CO2 Capture

    R. Belgamwar, A. Maity, Tisita Das, Sudip Chakraborty, C. Vinod, V. Polshettiwar, Chemical Science, 12, 4825(2021)
  15. Unveiling the Roles of Lattice Strain and Descriptor Species on Pt-like Oxygen Reduction Activity in Pd-Bi catalyst

    S Sarkar, S. Ramarao, Tisita Das, R. Das, C. Vinod, Sudip Chakraborty, S Peter, ACS Catalysis, 11, 800(2021)
  16. Stable Deep Blue Emission with Unity Quantum Yield in Organic-Inorganic Halide Perovskite 2D Nanosheets Doped with Cerium and Terbium at High Concentrations

    S. Parveen, Ponnappa K. P., Sudip Chakraborty*, P. K. Giri*, J.Mater.Chem. C, 9, 2437(2021)
  17. Organic-Inorganic Hybrid and Inorganic Halide Perovskites: Structural and Chemical Engineering, Interfaces and Optoelectronic Properties

    S. Krishnamurthy†, P. Pandey†, J. Kaur†, Sudip Chakraborty*, P. Nayak*, A. Sadhanala*, S. B. Ogale*, Journal of Physics D: Applied Physics, 54, 133002(2021) [Invited Topical Review Article]. [†=equal contributing first author]
  18. Charge Transfer Driven Interaction of CH4, CO2 and NH3 with TiS2 monolayer: Influence of Vacancy Defect

    Tisita Das, Sudip Chakraborty*, R. Ahuja*, Y. Kawazoe, G. P. Das*, Catalysis Today, 370, 189(2021)
  19. Formation of Corrugated n=1 2D Tin-Iodide Perovskites and their Use as Lead-Free Solar Absorber

    B. Febriansyah, Y. Lekina, J. Kaur, T. Hooper, P. Harikesh, T. Salim, M. Lim, T. Koh, Sudip Chakraborty*, Z. Shen*, N. Mathews*, J. England*, ACS Nano, 15, 6395(2021)

2020

  1. ns2 Electron (Bi3+ and Sb3+) Doping in Lead-Free Metal Halide Perovskite Derivatives

    H Arfin†, A Kshirsagar†, J. Kaur†, B Mondal, Z Xia, Sudip Chakraborty*, Angshuman Nag*, Chem.Mater. 36, 10255(2020) [†=equal contributing first author]
  2. Emerging Piezochromism in Lead free Alkaline Earth Chalcogenide Perovskite AZrS3(A = Mg, Ca, Sr and Ba) under Pressure

    A. Majumdar, A. Adeleke, Sudip Chakraborty*, R. Ahuja*, J.Mater.Chem. C, 8, 16392(2020) [Featured as HOT Paper]
  3. Shaping a Doped Perovskite Oxide with Measured Grain Boundary Defects to Catalyze Bifunctional Oxygen Activation for Rechargeable Zn-air Battery

    R. Majee, Tisita Das, Sudip Chakraborty, S. Bhattacharyya, ACS Appl.Mater.Interfaces, 12, 40355(2020)
  4. Anisotropic photoconductivity and long-lived charge carriers in Bismuth-based one-dimensional perovskite with Type-IIa Band Alignment

    J. Pious, Manasa G. B., C. Muthu, N. Krishna, R. Nishikubo, A. Saeki, Sudip Chakraborty*, V. C. Nair*, J.Phys.Chem. Lett, 11, 6757(2020)
  5. Reaction coordinate mapping of hydrogen evolution mechanism on Mg3N2 monolayer

    A. Banerjee, Sudip Chakraborty, R. Ahuja, Int.J. Hydrogen Energy, 45, 22848(2020)
  6. Lewis acid-base interactions between polysulfides and boehmite enables stable room-temperature sodium–sulfur batteries

    A. Ghosh, A. Kumar, Tisita Das, A. Ghosh, Sudip Chakraborty, M. Kar, D. MacFarlane, S. Mitra, Advanced Functional Materials, 30, 2005669(2020)
  7. Emerging Piezochromism in Transparent Lead free Perovskite Rb3X2I9 (X=Sb, Bi) under Compression: A Comparative Theoretical Insight

    A. Majumdar, Sudip Chakraborty*, R. Ahuja*, Journal of Applied Physics, 128, 045102(2020) [Featured as Editor's Pick Article]
  8. Enhanced Electrocatalytic Activity in Geometrically Designed Epitaxial SrRuO3 Thin Films

    A. Biswas, G. Shanker, Tisita Das, R. Mandal, Sudip Chakraborty*, S. B. Ogale*, Applied Surface Science, 529, 147065(2020)
  9. Understanding the interplay of stability and efficiency in A-site engineered lead halide perovskites

    F. Ünlü, E. Jung, J. Haddad, A. Kulkarni, S. Öz, H. Choi, T. Fischer, Sudip Chakraborty, T. Kirchartz, S. Mathur, APL Materials, 8, 070901(2020) [Invited Perspective Article, Featured as Editor's Choice]
  10. Solid State Synthesis of Stable and Color Tunable Cesium Lead Halide Perovskite Nanocrystals and Mechanism of High-Performance Photodetection in Monolayer MoS2/CsPbBr3 Vertical Heterojunction

    J. Ghosh, L. Mawlong, Manasa G. B.; M. Hossain, A. Pattison, W. Theis, Sudip Chakraborty*, P. K. Giri* J.Mater.Chem. C, 8, 8917(2020)
  11. High exothermic dissociation in van-der-Waals like hexagonal two-dimensional nitrogene from first-principles molecular dynamics

    A. Majumdar, X. Yang, W. Luo, S. Chowdhury, Sudip Chakraborty, R. Ahuja, Applied Surface Science, 529, 146552(2020)
  12. Bi3+ -Er3+ and Bi3+ -Yb3+ codoped Cs2AgInCl6 Double Perovskite Near Infrared Emitter

    H. Arfin, J. Kaur, T. Sheikh, Sudip Chakraborty*, Angshuman Nag*, Angewandte Chemie, 59, 11307(2020) (Featured as HOT Paper)
  13. Facets and Defects in Perovskite Nanocrystals for Photocatalytic CO2 Reduction

    S. Shyamal, S. Dutta, Tisita Das, Sudip Chakraborty*, N. Pradhan*, J.Phys.Chem. Lett. 11, 3608(2020)
  14. Combinatorial design and computational screening of 2D transition metal tri-chalcogenide monolayers: Towards efficient catalysts for hydrogen evolution reaction

    P. Sen, K. Alam, Tisita Das, R. Banerjee, Sudip Chakraborty, J.Phys.Chem. Lett. 11, 3192(2020)
  15. Tweaking Nickel with Minimal Silver in a Heterogeneous Alloy of Decahedral Geometry to Deliver Platinum-like Hydrogen Evolution Activity

    R. Majee, A. Kumar, Tisita Das, Sudip Chakraborty, S. Bhattacharyya, Angewandte Chemie, 59, 2(2020)

2019

  1. Single Atomic Vacancy Catalysis

    J. Yang, Y. Wang, M. Lagos, V. Manichev, R. Fullon, X. Song, D. Voiry, Sudip Chakraborty, W. Zhang, P. Batson, L. C. Feldman, T. Gustafsson, Manish Chhowalla, ACS Nano, 13, 9958(2019)
  2. Designing a new family of oxonium-cation based structurally diverse organic-inorganic hybrid iodoantimonate crystals

    S. Parmar, S. Pal, S. Biswas, S. Gosavi, Sudip Chakraborty*, M. Reddy, S. Ogale*, Chem.Comm. 55, 7562(2019)
  3. Emergence of Si2BN monolayer as Efficient HER catalyst under co-functionalization influence

    D. Singh*, Sudip Chakraborty*, R. Ahuja*, ACS Applied Energy Materials, 2, 8441(2019)
  4. Rashba Triggered Electronic and Optical Properties Tuning in Mixed Cation-Mixed Halide Hybrid Perovskites

    A. Banerjee*, Sudip Chakraborty*, R. Ahuja*, ACS Applied Energy Materials, 2, 6990(2019)
  5. Defect Thermodynamics in Alluaudite-based Polyanionic Materials: A Theoretical Insight of Non-stoichiometry Influences

    T. Watcharatharapong*, Sudip Chakraborty*, R. Ahuja, ACS Appl.Mater.Interfaces, 11, 32856(2019)
  6. Functionalization and Defect Driven HER and OER Mechanism on Quasi Two-Dimensional TiO2 Hexagonal Nanosheet

    Tisita Das, Sudip Chakraborty*, R. Ahuja, G. P. Das*, ACS Applied Energy Materials, 2, 5074(2019)
  7. Mapping Sodium Intercalation Mechanism, Electrochemical Properties and Structural Evolution in Non-stoichiometric Alluaudite Cathode Materials

    Teeraphat Watcharatharapong*, Sudip Chakraborty*, R. Ahuja, J.Mater.Chem. A, 7, 17446(2019)
  8. Limiting Heterovalent B-site Doping in CsPbI3 Nanocrystals: The Phase and Optical Stability

    S. Bera, D. Ghosh, A. Dutta, S. Bhattacharyya, Sudip Chakraborty*, N. Pradhan*, ACS Energy Letters, 4, 1364(2019)
  9. Cesium Bismuth Iodide Solar Cells from Systematic Molar Ratio variation of CsI and BiI3

    M. Johansson, B. Philippe, A. Banerjee, D. Phuyal, S. Mukherjee, Sudip Chakraborty, M. Cameau, H. Zhu, R. Ahuja, G. Boschloo, H. Rensmo, E. Johansson Inorg.Chem. 58, 12040 (2019)
  10. Cu-doped nickel oxide interface layer with nanoscale thickness for efficient and highly stable printable carbon-based perovskite solar cell

    A. Bashir, L. Haur, S. Shukla, D. Gupta, T. Baikie, Sudip Chakraborty, R. Patidar, A. Bruno, S. Mhaisalkar, Z. Akhter, Solar Energy, 182, 225(2019)
  11. A zero-dimensional lead-free hybrid perovskite with a quantum-well structure

    J. Pious, A. Katre, C. Muthu, Sudip Chakraborty, S. Krishna, V. C. Nair, Chem.Mater. 31, 1941(2019)
  12. Phase evolution in calcium molybdate nanoparticles as a function of synthesis temperature and its electrochemical effect on energy storage

    M. Minakshi, D. Mitchell, C. Baur, J. Chable, A. Barlow, M. Fichtner, A. Banerjee, Sudip Chakraborty, R. Ahuja, Nanoscale Advances, 1, 565(2019) [Most Popular Articles Collection of Nanoscale Advances]
  13. TiS2 Monolayer Emerging as Ultrathin Bifunctional Catalyst:Influence of Defect and Functionalization

    Tisita Das, Sudip Chakraborty*, R. Ahuja, G. P. Das*, ChemPhysChem,20, 608(2019)
  14. Composition Dependent Tuning of Electronic and Magnetic Properties in Transition Metal Substituted Rock-Salt MgO

    K. Klaa, S. Labidi, A. Banerjee, Sudip Chakraborty, M. Labidi, A. Amara, M. Bououdina, R. Ahuja, J.Magn.Magn.Mater, 475, 44(2019)
  15. Defect formations and pH-dependent kinetics in kröhnkite Na2Fe(SO4)2.2H2O based cathode for sodium-ion batteries Resembling synthesis conditions through chemical potential landscape

    T. Watcharatharapong, J. Thieprasert, Sudip Chakraborty, R. Ahuja, Nano Energy,55, 123(2019)

2018

  1. In Pursuit of Bifunctional Catalytic Activity in PdS2 pseudo-monolayer through Reaction Coordinate Mapping

    D. Saraf, Sudip Chakraborty*, A. Kshirsagar*, R. Ahuja*, Nano Energy, 49, 283(2018)
  2. Mechanistic Insight of Enhanced Hydrogen Evolution Reaction Activity of Ultra-thin h-BN Modified Pt Electrodes

    A. Guha, T. Vineesh, A. Sekar, S. Narayanaru, M. Sahoo, S. Nayak, Sudip Chakraborty*, T. N. Narayanan*, ACS Catalysis, 8, 6636(2018)
  3. Molecular and self-trapped excitonic contributions to the broadband luminescence in diamine based low dimensional hybrid perovskites systems

    S. Krishnamurthy, R. Naphade, W.Mir, S. Gosavi, Sudip Chakraborty*, R.Vaidhyanathan, S. B. Ogale*, Advanced Optical Materials, 17, 1800751 (2018)
  4. Scrupulous Probing of Bifunctional Catalytic Activity of Borophene Monolayer: Mapping Reaction Coordinate with Charge Transfer

    A. Banerjee*, Sudip Chakraborty*, N. Jena*, R. Ahuja*, ACS Applied Energy Materials, 1, 3571(2018)
  5. Simultaneous enhancement in charge separation and onset potential for water oxidation in BiVO4 photoanode by W-Ti codoping

    X. Zhao, J. Hu, B. Wu, A. Banerjee, Sudip Chakraborty*, J. Feng, Z. Xhao, S. Chen, R. Ahuja, T. C. Sum, Z. Chen*, J.Mater.Chem. A, 6, 16965(2018)
  6. Current Computational Trends in Polyanionic Cathode Materials for Li and Na batteries

    Sudip Chakraborty*, A. Banerjee, Teeraphat Watcharatharapong, R. Araujo, R. Ahuja, J. Phys.: Condens. Matter. 30, 283003(2018) [Invited Article - Topical Review]
  7. Maneuvering the Physical Properties and Spin States to Enhance the Activity of La-Sr-Co-Fe-O Perovskite Oxide Nanoparticles in Electrochemical Water Oxidation

    R. Majee, Sudip Chakraborty, H. Salunke, S. Bhattacharrya, ACS Applied Energy Materials, 1, 3342(2018)
  8. Defected and Functionalized Germanene based Nanosensors under Sulfur Comprising Gas Exposure

    T. Hussain, T. Kaewmaraya, Sudip Chakraborty, H. Vovusha, V. Amornkitbamrung, R. Ahuja, ACS Sensors, 3, 867(2018)
  9. Investigation on Organic Molecule Additive for Moisture Stability and Defect Passivation via Physisorption in CH3NH>3PbI3 based Perovskite

    S. Singh, B. Sharma, S. Gangadhar, A. Dey, Sudip Chakraborty, K. Narashimhan, P. Bhargava, D. Kabra, ACS Applied Energy Materials 1, 1870(2018)
  10. Synthesis and Optical Properties of Colloidal M3Bi2I9(M =Cs,Rb) Perovskite Nanocrystals

    J. Pal, A. Bhunia, Sudip Chakraborty, S. Manna, S. Das, A. Diwan, S. Datta, Angshuman Nag, J.Phys.Chem. C, 122, 10643(2018)
  11. New Concept on Photocatalytic Degradation of Thiophene Derivatives: Experimental and DFT Studies

    N. Djouambi, C. Bougheloum, A. Messalhi, M. Bououdina, A. Banerjee, Sudip Chakraborty, R. Ahuja, J.Phys.Chem. C, 122, 15646(2018)
  12. Cystamine-configured lead halide based 2D hybrid molecular crystals: Synthesis and photoluminescence systematics

    S. Krishnamurthy, P. Kour, A. Katre, S. Gosavi, Sudip Chakraborty*, S. B. Ogale*, APL Materials, 6, 114204(2018)
  13. A combined theoretical and experimental approach of a new ternary metal oxide in molybdate composite for hybrid energy storage capacitors

    M. Minakshi, T. Watcharatharapong, Sudip Chakraborty, R. Ahuja, APL Materials, 6, 047701(2018)
  14. Saline Accelerates Oxime Reaction with Aldehyde and Keto Substrates at Physiological pH

    S. Wang, G. Nawale, S. Kadekar, O. Oommen, N. Jena, Sudip Chakraborty, J. Hilborn, O. Varghese, Sci. Rep. 8, 2193(2018)
  15. Theoretical Evidences Behind Bifunctional Catalytic Activity in Pristine and Functionalized Al2C monolayer

    R. Almeida, A. Banerjee, Sudip Chakraborty*, J. Almeida*, R. Ahuja, ChemPhysChem, 19, 148(2018)

2017

  1. Rational Design: A High-Throughput Computational Screening and Experimental Validation Methodology for Lead-free and Emergent Hybrid Perovskites

    Sudip Chakraborty*, W. Xie, N. Mathews, M. Sherburne, R. Ahuja, M. Asta, S. G. Mhaisalkar, ACS Energy Letters, 2, 837(2017)
  2. Mechanistic study of Na-ion diffusion and small polaron formation in Kröhnkite Na2Fe(SO4)2.2H2O based cathode material

    T. Watcharatharapong, J. Thienprasert, P. Barpanda, R. Ahuja, Sudip Chakraborty*, J.Mater.Chem. A, 5, 21726(2017)
  3. Bromination Induced Stability Enhancement with Multivalley Optical Response Signature in Guanidinium [C(NH2)3]+ Based Hybrid Perovskite Solar Cells

    A. Banerjee, Sudip Chakraborty*, R. Ahuja, J.Mater.Chem. A, 5, 18561(2017)
  4. Evolution of hydrogen by few-layered black phosphorus under visible illumination

    S. Muduli, V. Eswaraiah, X. You, S. Kulkarni, A. Katre, Sudip Chakraborty, S. Chen, T. C. Sum, X. Rong, N. Mathews, J.Mater.Chem.A, 5, 24874(2017)
  5. Effect of transition metal cations on stability enhancement for molybdate based hybrid supercapacitor

    T. Watcharatharapong, M. Minakshi, Sudip Chakraborty*, D. Li, G. Shafiullah, R. Aughterson, R. Ahuja, ACS Appl.Mater.Interfaces, 9, 17977(2017)
  6. A Comparative Study of Hydrogen Evolution Reaction on pseudo-monolayer WS2 and PtS2:Insights based on the density functional theory

    S. Mir, Sudip Chakraborty*, J. Warna, S. Narayan, P.C. Jha, P.K. Jha, R. Ahuja, Catal.Sci.Technol. 7, 687(2017)
  7. Valence Level Character in a Mixed Perovskite Material and Determination of the Valence Band Maximum from Photoelectron Spectroscopy: Variation with Photon Energy

    B. Philippe, T. Jacobsson, J-P. Correa-Baena, N. Jena, A. Banerjee, Sudip Chakraborty, U. Cappel, R. Ahuja, Anders Hagfeldt, M. Odelius, Håkan Rensmo, J.Phys.Chem. C, 121, 26655(2017)
  8. Poor Photovoltaic Performance of Cs3Bi2I9: An Insight Through First Principles Calculations

    B. Ghosh, Sudip Chakraborty, H. Wei, C. Guet, S. Li, S. Mhaisalkar, N. Mathews, J.Phys.Chem. C, 121, 17062(2017)
  9. Na2.32Co1.84(SO4)3 as a New Member of Alluaudite Family of High-Voltage Sodium Battery Cathode

    D. Dwibedi, R. Gond, A. Dayamani, R. Araujo, Sudip Chakraborty, R. Ahuja, P. Barpanda, Dalton Trans. 46, 55(2017)
  10. Improved Sensing Characteristics of Methane on ZnO Nano-Sheet upon Implanting Defects and Foreign Atoms Substitution

    T. Hussain, T. Kaewmaraya, M. Khan, Sudip Chakraborty*, M. Islam, V. Amornkitbamrung, R. Ahuja, Nanotechnology, 28, 415502(2017)
  11. Cluster assembly route to a novel octagonal two-dimensional ZnO monolayer

    P. Gaikwad, P. Pujari, Sudip Chakraborty, A. Kshirsagar, J. Phys.: Condens. Matter., 29, 335501(2017)
  12. Design and Control of Cooperativity in Spin-Crossover in Metal-organic Complexes: A Theoretical Overview

    H. Banerjee, Sudip Chakraborty, T. Saha-Dasgupta, Inorganics, 5, 47(2017)[Invited Article - Review]
  13. Role of relativity in high-pressure phase transitions of thallium

    K. Kotmool, Sudip Chakraborty, T. Bovornratanaraks, R. Ahuja, Sci.Rep. 7, 42983(2017)

2016

  1. Cationic Effect on Pressure driven Spin-State Transition and cooperativity in Hybrid Perovskites

    H. Banerjee, Sudip Chakraborty, T. Saha-Dasgupta, Chem.Mater. 28, 8379(2016)
  2. High pressure induced distortion in Face-centered-cubic phase of Thallium

    K. Kotmool, B. Li, Sudip Chakraborty, T. Bovornratanaraks, W. Luo, Ho-Kwang Mao, R. Ahuja, PNAS, 113, 11143(2016)
  3. Predicting Electrochemical Properties and Ionic Diffusion in Na2+2xMn2-x(SO4)3: Crafting a Promising High Voltage Cathode Material

    R. Araujo, M. Islam, Sudip Chakraborty*, R. Ahuja, J.Mater.Chem. A, 4, 451(2016)[Selected as HOT Article]
  4. Synthesis, structural and electrochemical properties of sodium nickel phosphate for energy storage devices

    M. Minakshi, D. Mitchell, R. Jones, F. Alenazey, T. Watcharatharapong, Sudip Chakraborty, R. Ahuja, Nanoscale, 8, 11291(2016)
  5. Ionothermal Synthesis of High-voltage Alluaudite Na2+xFe2-x(SO4)3 Sodium Insertion Compound: Structural, Electronic and Magnetic Insight

    D. Dwibedi, C. Ling, R. Araujo, Sudip Chakraborty, S. Duraisamy, N. Munichandraiah, R. Ahuja, P. Barpanda, ACS Appl.Mater.Interfaces, 8, 6982(2016)
  6. Rationalizing Hydrogen and Oxygen Evolution Reaction Activity of Two-dimensional Hydrogenated Silicene and Germanene

    C. Rupp, Sudip Chakraborty*, J. Anversa, R. Baierle, R. Ahuja, ACS Appl.Mater.Interfaces, 8, 1536(2016)
  7. Defect and Substitution Induced Silicene Sensor to Probe Toxic Gases

    T. Hussain, T. Kaewamaraya, Sudip Chakraborty*, R. Ahuja, J.Phys.Chem. C 120, 25256(2016)
  8. Probing the Pseudo-1-D Ion Diffusion in Lithium Titanium Niobate Anode for Li-ion Battery

    S. Das, D. Dutta, R. Araujo, Sudip Chakraborty, R. Ahuja, A. J. Bhattacharyya, PhysChemChemPhys, 18, 22323(2016)
  9. Na2M2(SO4)3 (M=Fe, Mn, Co and Ni): Towards High Voltage Sodium Battery Applications

    R. Araujo, Sudip Chakraborty*, P. Barpanda, R.Ahuja, PhysChemChemPhys, 18, 9658(2016)
  10. Two-dimensional Boron: Lightest Catalyst for Hydrogen and Oxygen Evolution Reaction

    S. Mir, Sudip Chakraborty*, P. K. Jha, J. Warna, H. Soni, P. Jha, R. Ahuja, Applied Physics Letters, 109, 053903(2016)
  11. High pressure driven superconducting critical temperature tuning in Sb2Se3 topological insulator

    J. Anversa, Sudip Chakraborty*, P. Piquini, R. Ahuja, Applied Physics Letters, 108, 212601(2016)
  12. Nanostructured materials for solid-state hydrogen storage: A review of the achievement of COST Action MP1103

    E. Callini, K. A-Zinsou, R. Ahuja, J. Ares, S. Bals, N. Biliskov, Sudip Chakraborty, et al. Int. J. Hydrogen Energy, 41, 14404(2016) [Invited Article - Review]
  13. Time Dependent DFT Investigation of Optical Response in Pristine and Gd Doped Al2O3

    S. Kumavat, Sudip Chakraborty*, A. B. Rahane, M. D. Deshpande, R. Ahuja, RSC Advances, 6, 72537(2016)
  14. Rare earth functionalization effect in optical response of ZnO nano clusters

    M. Mahabal, M. Deshpande, Sudip Chakraborty, T. W. Kang, R. Ahuja, Eur. Phys. J D, 70, 1(2016)

2015

  1. Mapping Structural Changes in Electrode Materials: Application of the Hybrid eigenvector-following DFT Method to Layered Li0.5MnO2

    Ieuan Seymour, Sudip Chakraborty, Derek Middlemiss, David J. Wales, Clare P. Grey, Chem.Mater., 27, 5550(2015)
  2. Defect Engineered g-C3N4 for Efficient Visible Light Photocatalytic Hydrogen Production

    Q. Tay, P. Kanhere, C. Ng, S. Chen, Sudip Chakraborty, A. Huan, T. Sum, R. Ahuja, Z. Chen, Chem.Mater., 27, 4930(2015)
  3. Na2.44Mn1.79(SO4)3: A new member of alluaudite family of insertion compound for sodium ion batteries

    D. Dwibedi, R. Araujo, Sudip Chakraborty, P. Shanbogh, N. Sundaram, R. Ahuja, P. Barpanda, J.Mater.Chem. A, 3, 18564(2015)
  4. Hydrogen storage materials for mobile and stationary applications: Current state of the art

    Q. Lai, M. Paskevicius, D. Sheppard, C.E. Buckley, A. Thornton, M. Hill, Q. Gu, J. Mao, Z. Huang, H. Liu, Z. Guo, A. Banerjee, Sudip Chakraborty, R. Ahuja, K.F. Aguey-Zinsou, ChemSusChem, 8, 2789(2015)[Invited Article - Review]
  5. Highly Sensitive and Selective Gas Detection Based on Silicene

    J. Prasongkit, R. G. Amorim, Sudip Chakraborty, R. Ahuja, R. H. Scheicher, V. Amornkitbamrung, J.Phys.Chem. C, 119, 16934(2015)
  6. The effect of impurities in ultra-thin hydrogenated silicene and germanene: a first principles study

    C. Rupp, Sudip Chakraborty, R. Ahuja, R. Baierle, PhysChemChemPhys, 17, 22210(2015)
  7. Unveiling the charge migration mechanism in Na2O2: Implications to sodium air batteries

    R. B. Araujo, Sudip Chakraborty*, R. Ahuja, PhysChemChemPhys, 17, 8203(2015)
  8. Synthesis, crystal and electronic structure of sodium metal phosphate for hybrid capacitor in non-aqueous electrolyte

    M. Minakshi, T. Watcharatharapong, Sudip Chakraborty, R. Ahuja, S. Duraisamy, P. Rao, N. Munichandraiah, Dalton Trans., 44, 20108(2015)
  9. Improvement in Hydrogen Desorption from β and γ-MgH2 upon Transition Metal Doping

    T. Hussain, T. Maark, Sudip Chakraborty, R. Ahuja, ChemPhysChem, 16, 12, 2557(2015) [VIP Article & Cover Profile]
  10. Substitution induced band structure shape tuning in hybrid perovskites (CH3NH3Pb1-xSnxI3) for efficient solar cell applications

    P. Kanhere, Sudip Chakraborty*, C. Rupp, R. Ahuja, Z. Chen, RSC Advances, 5, 107497(2015)
  11. The Effect of Morphology and Confinement on the High-Pressure Phase Transition in ZnO Nanostructure

    K. Kotmool, T. Bovornratanaraks, Sudip Chakraborty, R. Ahuja, Journal of Applied Physics, 117, 114309(2015)
  12. BC3 Sheet Functionalized with Lithium Rich Species Emerging as a Reversible Hydrogen Storage Material

    T. Hussain, Sudip Chakraborty*, T. W. Kang, Borje Johansson, Rajeev Ahuja, ChemPhysChem, 16, 634(2015)

2014

  1. Revealing an unusual transparent phase of superhard Iron Tetraboride under high pressure

    K. Kotmool, T. Kaewmaraya, Sudip Chakraborty, J. Anversa, T. Bovornratanaraks, W. Luo, H. Gou, P. Piquini, T. Kang, Ho-Kwang Mao, R. Ahuja, PNAS, 111, 17050(2014)
  2. Mono-and co-doped NaTaO3 for visible light photocatalysis

    P. Kanhere, P. Shenai, Sudip Chakraborty, R. Ahuja, J. Zheng, Z. Chen, PhysChemChemPhys, 16, 30,16085(2014)
  3. A Possible Mechanism for the Emergence of Additional Band Gap due to Ti-O-C /Ti-C Bonds in TiO2 -Graphene Hybrid System for Enhanced Photodegradation of Methylene Blue under Visible Light

    S. Umrao, S. Abraham, F. Theil, S. Pandey, V. Ciobota, P. K. Shukla, C. J. Rupp, Sudip Chakraborty, R. Ahuja, J. Popp, B. Dietzek, A. Srivastava, RSC Advances, 4, 59890(2014)
  4. Enhancement of energy storage capacity of Mg functionalized silicene and silicane under external strain

    T. Hussain, Sudip Chakraborty, A. De Sarkar, Borje Johansson, R. Ahuja, Applied Physics Letters, 105, 123903(2014)
  5. Electronic density-of-states of amorphous vanadium pentoxide films: Electrochemical data and density functional theory calculations

    I. Lykissa, Shu-Yi Li, M. Ramzan, Sudip Chakraborty, R. Ahuja, Claes G. Granqvist, Gunnar A. Niklasson, Journal of Applied Physics, 115, 183701(2014)

2013

  1. Functionalization of hydrogenated silicene with alkali and alkaline earth metals for efficient hydrogen storage

    T. Hussain, T. Kaewmaraya, Sudip Chakraborty*, R. Ahuja, PhysChemChemPhys, 15, 18900(2013)
  2. Stabilizing a hexagonal Ru2C via Lifshitz transition under pressure

    W. Sun, Sudip Chakraborty*, R. Ahuja, Applied Physics Letters, 103, 251901(2013)
  3. Metal-Functionalized Silicene for Efficient Hydrogen Storage

    T. Hussain, Sudip Chakraborty*, R. Ahuja, ChemPhysChem, 14, 3463(2013)
  4. Electronic and optical properties of agglomerated hydrogen terminated silicon nanoparticles

    P. Francis, S. Patil, Ch. Rajesh, Sudip Chakraborty, S. Mahamuni, C. V Dharmadhikari, S. V. Ghaisas, Eur.Phys.J. D, 67, 144(2013)

2008-2012

  1. Optical Properties Of Gallium Oxide Clusters From First-Principles Calculations

    A. Rahane, M. Deshpande, Sudip Chakraborty, J.Phys.Chem. A, 116, 10559(2012)
  2. Relative Localization Prediction in Covalent Clusters: an ab-initio Theory Driven Quest

    Sudip Chakraborty*, S.V. Ghaisas, Adv.Sci.Lett., 18, 208(2012)
  3. First principles based adsorption comparison of Group-IV elements(C,Si,Ge,Sn) on Au/Ag(111) surface

    Sudip Chakraborty*, Ch. Rajesh, J. Nanopart. Research, 14, 1187(2012)
  4. An ab-initio study of silicon adsorption on metallic surfaces (Au/Ag): Novel perspective to explore chemical bonding

    Sudip Chakraborty*, S.V. Ghaisas, C. Majumder, Eur.Phys.J. B, 85, 227(2012)
  5. Structural and Optical Properties of Oxygenated Silicon Quantum Dots

    Sudip Chakraborty*, Ch. Rajesh, S. Mahamuni, S.V. Ghaisas, Adv.Sci.Lett., 4, 3580(2011)
  6. Oxygen impact on Quantum Confinement Effect for silicon clusters in different size regimes: ab-initio investigations

    Sudip Chakraborty *, Ch. Rajesh, S. Mahamuni, S.V. Ghaisas, Eur.Phys.J. D, 64, 331(2011)
  7. Quantum Confinement effect in pristine and oxygen covered silicon nanocrystals with surface states

    Sudip Chakraborty*, Ch. Rajesh, S. Mahamuni, S.V. Ghaisas, J.Comp.Theo.Nanoscience, 8, 1739(2011)
  8. Structure and Energetics of Silicon clusters adsorbed on Au(111) Surface: A first principles study

    Sudip Chakraborty, S.V. Ghaisas, C. Majumder, International Journal of Nanotechnology, 7, 833(2010)
  9. Ab-initio Calculation for the Study of Nano Scale Silicon-based Structure

    Sudip Chakraborty*, G. Shashidhar, S.V. Ghaisas, V. Sundararajan, Solid State Phenomena, 139, 113(2008)

Sudip Chakraborty | sudipchakraborty@hri.res.in, sudiphys@gmail.com

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