Prof R. S. Swathi
Professor (Chemistry)
Publications
For latest publications, see: https://scholar.google.com/citations?user=9ipAiU0AAAAJ&hl=en
| S. No. | Author(s) | Title | Name of Journal | Volume | Page | Year |
| 64. | Ashwani K. Tiwari, Rotti Srinivasamurthy Swathi, Neelanjana Sengupta, Balakrishnan Naduvalath | Structure and dynamics of chemical systems: Honouring N. Sathyamurthy's 75th birthday | Phys. Chem. Chem. Phys. | 28 | 17142 | 2026 |
| 63. | Aswathy Raveendran, Neenu Joseph, & Rotti Srinivasamurthy Swathi | Twist-Induced Chiroptical Response in Stacked Triangular Nanoprism Dimers: Leveraging the Lightning-Rod Effect | ACS Applied Nano Materials | 9 | 13755 | 2026 |
| 62. | Megha Rajeevan, Ajay Melekamburath, & Rotti Srinivasamurthy Swathi | Adsorption of Aromatic Hydrocarbons on Graphene: From Energy Decomposition to Stable Adsorption Geometries | Chem. Asian. J. | 21 | e70603 | 2026 |
| 61. | Megha Rajeevan, Niha, Chris John, Shobhita Mani & Rotti Srinivasamurthy Swathi | Particle Swarm Optimization in the Realm of Chemistry: From Theory to Applications | Chem. Soc. Rev. | 55 | 9-29 | 2026 |
| 60. | Anto James & Rotti Srinivasamurthy Swathi | Modeling the Inversion of Buckybowls on Graphynes for Shape-Complementary Catalysis | J. Phys. Chem. C | 129 | 18946-18958 | 2025 |
| 59. | Niha, Megha Rajeevan & Rotti Srinivasamurthy Swathi | Are the Lennard-Jones Potential Parameters Endowed with Transferability? Lessons Learnt from Noble Gases | Pure Appl. Chem. | 1 | 1 | 2025 |
| 58. | Akhil Kottayil, Medha Sangeetha Prakash & Rotti Srinivasamurthy Swathi | Cation–π Interactions Involving Graphynes: An Intermolecular Force Field Formulation Featuring Ion-Induced Dipole Effects | J. Phys. Chem. C | 129 | 14130-14144 | 2025 |
| 57. | Megha Rajeevan & Rotti Srinivasamurthy Swathi | Leveraging Metaheuristics to Uncover Water Confinement in Multilayer Graphynes | Phys. Chem. Chem. Phys. | 27 | 17598-17614 | 2025 |
| 56. | Mavilakizhakke Puthiyaveetil Ajaykumar, Neenu Joseph, Aswathy Raveendran, Ranguwar Rajendra, Rotti Srinivasamurthy Swathi & K. George Thomas | Polarization-Resolved Spectral Features and Dielectric Medium Effects in Plexcitonic Systems: Findings from Single-Particle Spectroscopy | J. Phys. Chem. C | 129 | 542-551 | 2025 |
| 55. | Neenu Joseph, Aswathy Raveendran, Belvin Thomas, Reshmi Thomas & Rotti Srinivasamurthy Swathi | Selectivity and Switchability of Hot Spot Activation in Nanolens-like Nanosphere Heterotrimers | ACS Appl. Opt. Mater. | 2 | 1891-1902 | 2024 |
| 54. | Megha Rajeevan, Chris John & Rotti Srinivasamurthy Swathi | On Assessing the Carbon Capture Performance of Graphynes with Particle Swarm Optimization | Phys. Chem. Chem. Phys. | 26 | 23152-23167 | 2024 |
| 53. | Jessica Rühe, Megha Rajeevan, Kazutaka Shoyama, Rotti Srinivasamurthy Swathi, Frank Würthner | A Terrylene Bisimide based Universal Host for Aromatic Guests to Drive Contact Surface- Dependent Dispersion Energies | Angew. Chem. | - | e202318451-e202318451 | 2024 |
| 52. | Megha Rajeevan & Rotti Srinivasamurthy Swathi | Exploring the Energy Landscape of Graphynes for Noble Gas Adsorption using Swarm Intelligence | AICHEM | 2 | 2949-7477 | 2024 |
| 51. | Pallavi Panthakkal Das, Aniruddha Mazumder, Megha Rajeevan, Rotti Srinivasamurthy Swathi, Mahesh Hariharan | Energy Landscape of Prylenediimide Chromophoric Aggregates | Phys. Chem. Chem. Phys. | 26 | 2007-2015 | 2024 |
| 50. | Chris John & Rotti Srinivasamurthy Swathi | Global Optimization of Dinitrogen Clusters Bound to Monolayer and Bilayer Graphene: A Swarm Intelligence Approach | J. Phys. Chem. A | 127 | 4632-4642 | 2023 |
| 49. | Anto James & Rotti Srinivasamurthy Swathi | Halogen Bonding: A Designer Strategy for Graphyne-Like Two Dimensional Architectures | Theor. Chem. Acc. | 142 | 45 | 2023 |
| 48. | Mavilakizhakke Puthiyaveetil Ajaykumar,Ranguwar Rajendra, Reshmi Thomas, Rotti Srinivasamurthy Swathi, K. George Thomas | Single-Particle Investigation of Plexcitons in Bimetallic Nanorods | J. Phys. Chem. C | 127 | 14326-14335 | 2023 |
| 47. | Aiswarya M. Parameswaran, Anto James, Adil Aboobacker & Rotti Srinivasamurthy Swathi | Unfurling Anion-π Interactions in Graphynes | ChemPhysChem | 24 | e202200548 | 2023 |
| 46. | Chris John, Megha Rajeevan & Rotti Srinivasamurthy Swathi | Elucidation of Noble Gas Cluster Configurations Bound on Graphdiyne: A Metaheuristic Approach | Chem.: Asian J. | - | e202200625 | 2022 |
| 45. | Anto James & Rotti Srinivasamurthy Swathi | Modeling the Adsorption of Polycyclic Aromatic Hydrocarbons on Graphynes: An Improved Lennard-Jones Formulation | J. Phys. Chem. A | 126 | 3472 | 2022 |
| 44. | Anto James, Chris John, Ajay Melekamburath, Megha Rajeevan & Rotti Srinivasamurthy Swathi | A Journey towards the Heaven of Chemical Fidelity of Intermolecular Force Fields | WIREs Comput. Mol. Sci. | 12 | e1599 | 2022 |
| 43. | Chris John & Rotti Srinivasamurthy Swathi | An Anisotropic Dressed Pairwise Potential Model for the Adsorption of Noble Gases on Boron Nitride Sheets | Phys. Chem. Chem. Phys. | 24 | 2554-2566 | 2022 |
| 42. | Ajay Melekamburath, Anto James, Megha Rajeevan, Chris John & Rotti Srinivasamurthy Swathi | In Pursuit of Accurate Interlayer Potentials for Twisted Bilayer Graphynes | Phys. Chem. Chem. Phys. | 23 | 27031-27041 | 2021 |
| 41. | Rohini Krishnakumar, Anto James & Rotti Srinivasamurthy Swathi | Metal-Decorated Crown Ether-Embedded Graphene Nanomeshes for Enhanced Molecular Adsorption | Adv. Theory Simul. | 4 | 2100202 | 2021 |
| 40. | Hemna Fathima, Nandita Mohandas, Blesson Sam Varghese, Parvathy Anupkumar, Rotti Srinivasamurthy Swathi & K. George Thomas | Core-Shell Plasmonic Nanostructures on Au Films as SERS Substrates: Thickness of Film and Quality Factor of Nanoparticle Matter | J. Phys. Chem. C | 125 | 16024-16032 | 2021 |
| 39. | Chris John, Cheriyacheruvakkara Owais, Anto James & Rotti Srinivasamurthy Swathi | Swarm Intelligence Steers a Global Minima Search of Clusters Bound on Carbon Nanostructures | J. Phys. Chem. C | 125 | 2811-2823 | 2021 |
| 38. | Cheriyacheruvakkara Owais, Chris John & Rotti Srinivasamurthy Swathi | Swarm Intelligence Unravels the Confinement Effects for Tiny Noble Gas Clusters within Carbon Nanotubes | Eur. Phys. J. D | 75 | 16 | 2021 |
| 37. | Cheriyacheruvakkara Owais, Mahroof Kalathingal & Rotti Srinivasamurthy Swathi | Encapsulation of Monocyclic Carbon Clusters into Carbon Nanotubes: A Continuum Modeling Approach | Proc. Inst. Mech. Eng. Part N J. Nanomater.Nanoeng. Nanosyst. | 235 | 12 | 2021 |
| 36. | Anvy Kuriakose, Gopal Narmada Naidu & Rotti Srinivasamurthy Swathi | Plasmonic Resonances in Ag-Au Nanosphere Heterodimers: How Accurate are the Approximate Analytical Descriptions? | J. Phys. Chem. C | 124 | 13858–13871 | 2020 |
| 35. | Owais Cheriyacheruvakkara, Chris John & Rotti Srinivasamurthy Swathi | A Swarm Intelligence Modeling Approach Reveals Noble Gas Cluster Configurations Confined within Carbon Nanotubes | Phys. Chem. Chem. Phys. | 22 | 20693-20703 | 2020 |
| 34. | Meera Mohankumar, Mahima Unnikrishnan, Gopal Narmada Naidu, Sanoop Mambully Somasundaran, Mavilakizhakke Puthiyaveetil Ajaykumar, Rotti Srinivasamurthy Swathi & K. George Thomas | Finding the Needle in a Haystack: Capturing Veiled Plexcitonic Coupling through Differential Spectroscopy | J. Phys. Chem | 124 | 26387–26395 | 2020 |
| 33. | Rama Dhali, Chris John & Rotti Srinivasamurthy Swathi | Quantum Transmission of He Isotopes through Crown Ether-Embedded Graphene Nanomeshes: An Eckart Potential Approach | J. Phys. Chem. A | 123 | 7499-7506 | 2019 |
| 32. | Cheriyacheruvakkara Owais, Gopakumar Aswin & Rotti Srinivasamurthy Swathi | Encapsulation of He clusters into Carbon Nanotubes: A Modeling Strategy based on Continuum Approximation and Particle Swarm Optimization | J. Indian Chem. Soc. | 96 | 1019-1028 | 2019 |
| 31. | Anto James & Rotti Srinivasamurthy Swathi | Permeation of Fullerenes through Graphynes: Theoretical Design of Nanomechanical Oscillators | J. Phys. Chem. C | 123 | 10544-10556 | 2019 |
| 30. | Palasseri T. Sujai, Manu M Joseph, Varsha Karunakaran, Giridharan Saranya, Ramya N. Adukkadan, Shanmughan Shamjith, Reshmi Thomas, Jyothi B. Nair, Rotti Srinivasamurthy Swathi & Kaustabh Kumar Maiti | Biogenic Cluster-Encased Gold Nanorods as a Targeted Three-in-One Theranostic Nanoenvelope for SERS-Guided Photochemotherapy against Metastatic Melanoma | ACS Appl. Bio Mater. | 2 | 588-600 | 2019 |
| 29. | Mahroof Kalathingal, Cheriyacheruvakkara Owais, Devaraj Sundararaj Praveen Roy & Rotti Srinivasamurthy Swathi | Adsorption of Monocyclic Carbon Rings on Graphene: Energetics Revealed via Continuum Modeling | ACS Omega | 3 | 7542-7554 | 2018 |
| 28. | Cheriyacheruvakkara Owais, Anto James, Chris John, Rama Dhali & Rotti Srinivasamurthy Swathi | Selective Permeation through One-Atom-Thick Nanoporous Carbon Membranes: Theory Reveals Excellent Design Strategies! | J. Phys. Chem. B | 122 | 5127-5146 | 2018 |
| 27. | Hadiya Mecheri Abdulla, Reshmi Thomas & Rotti Srinivasamurthy Swathi | Overwhelming Analogies between Plasmon Hybridization Theory and Molecular Orbital Theory Revealed: The Story of Plasmonic Heterodimers | J. Phys. Chem. C | 122 | 7382-7388 | 2018 |
| 26. | Anto James, Chris John, Cheriyacheruvakkara Owais, Stephen Nagaraju Myakala, Sarap Chandra Shekar, Jyoti Roy Choudhuri & Rotti Srinivasamurthy Swathi | Graphynes: Indispensable Nanoporous Architectures in Carbon Flatland | RSC Adv. | 8 | 22998-23018 | 2018 |
| 25. | Sarap Chandra Shekar & Rotti Srinivasamurthy Swathi | Molecular Switching on Graphyne and Graphdiyne: Realizing Functional Carbon Networks in Synergy with Graphene | Carbon | 6 | 489-499 | 2018 |
| 24. | Reshmi Thomas, Jatish Kumar, Jino George, M Shanthil, G. Narmada Naidu, Rotti Srinivasamurthy Swathi & K. George Thomas | Coupling of Elementary Electronic Excitations: Drawing Parallels Between Excitons and Plasmons | J. Phys. Chem. Lett. | 9 | 919-932 | 2018 |
| 23. | Reshmi Thomas, Anoop Thomas, Saranya Pullanchery, Linta Joseph, Sanoop Mambully Somasundaran, Rotti Srinivasamurthy Swathi, Stephen K. Gray & K. George Thomas | Plexcitons: The Role of Oscillator Strengths and Spectral Widths in Determining Strong Coupling | ACS Nano | 12 | 402-415 | 2018 |
| 22. | Sarap Chandra Shekar, Sanjay Kumar Meena & Rotti Srinivasamurthy Swathi | Interlocked Benzenes in Triangular π-Architectures: Snchoring Groups Dictate Ion Binding and Transmission | Phys. Chem. Chem. Phys. | 19 | 10264-10273 | 2017 |
| 21. | Rohini Krishnakumar & Rotti Srinivasamurthy Swathi | Tunable Azacrown-Embedded Graphene Nanomeshes for Ion Sensing and Separation | ACS Appl. Mater. Interfaces | 9 | 999-1010 | 2017 |
| 20. | Tony George Thomas, Sarap Chandra Shekar, Rotti Srinivasamurthy Swathi and Karical Raman Gopidas | Triazatruxene Radical Cation: A Trigonal Class III Mixed Valence System | RSC Adv. | 7 | 821-825 | 2017 |
| 19. | Reshmi Thomas & Rotti Srinivasamurthy Swathi | Linear and Polygonal Assemblies of Plasmonic Nanoparticles: Incident Light Polarization Dictates Hot Spots | J. Phys. Chem. C | 120 | 18733-18740 | 2016 |
| 18. | Rohini Krishnakumar, Daniel M. R. Sylvinson & Rotti Srinivasamurthy Swathi | Intercalation of HF, H2O, and NH3 Clusters within the Bilayers of Graphene and Graphene Oxide: Predictions from Coronene-Based Model Systems | J. Phys. Chem. A | 119 | 10935-10945 | 2015 |
| 17. | Sarap Chandra Shekar & Rotti Srinivasamurthy Swathi | Cation-π Interactions and Rattling Motion through Two-Dimensional Carbon Networks: Graphene vs Graphynes | J. Phys. Chem. C | 119 | 8912-8923 | 2015 |
| 16. | B. Sree Ganesh, Devendra Singh & Rotti Srinivasamurthy Swathi | Noble Gas Encapsulation into Carbon Nanotubes: Predictions from Analytical Model and DFT Studies | J. Chem. Phys. | 141 | 184304 | 2014 |
| 15. | S. Chandra Shekar & Rotti Srinivasamurthy Swathi | Stability of Nucleobases and Base Pairs Adsorbed on Graphyne and Graphdiyne | J. Phys. Chem. C | 118 | 4516-4528 | 2014 |
| 14. | Jatish Kumar, Reshmi Thomas, Rotti Srinivasamurthy Swathi & K. George Thomas | Au Nanorod Quartets and Raman Signal Enhancement: Towards the Design of Plasmonic Platforms | Nanoscale | 6 | 10454-10459 | 2014 |
| 13. | Rohini K. & Rotti Srinivasamurthy Swathi | Host-Guest Interactions in the Confined Geometries Formed from Molecular Aggregates of Push-Pull Molecules | J. Phys. Chem. A | 117 | , 5794-5801 | 2013 |
| 12. | S. Chandra Shekar & Rotti Srinivasamurthy Swathi | Rattling Motion of Alkali Metal Ions through the Model Compounds of Graphyne and Graphdiyne | J. Phys. Chem. A | 117 | 8632-8641 | 2013 |
| 11. | Reshmi Thomas & Rotti Srinivasamurthy Swathi | Organization of Metal Nanoparticles for Surface-enhanced Spectroscopy: A Difference in Size Matters | J. Phys. Chem. C | 116 | 21982-21991 | 2012 |
| 10. | M Shanthil, Reshmi Thomas, Rotti Srinivasamurthy Swathi & K. George Thomas | Ag@SiO2 Core-Shell Nanostructures: Distance-Dependent Plasmon Coupling and SERS Investigation | J. Phys. Chem. Lett. | 3 | 1459-1464 | 2012 |
| 9. | Reshmi Thomas, Jatish Kumar, Rotti Srinivasamurthy Swathi & K. George Thomas | Optical effects near metal nanostructures: towards surface-enhanced spectroscopy | Curr. Sci. | 102 | 85-96 | 2012 |
| 8. | Amol M. Vibhute, Rajesh G. Gonnade, Rotti Srinivasamurthy Swathi & Kana M. Sureshan | Strength from Weakness: Opportunistic CH...O Hydrogen Bonds Differentially Dictate the Conformational Fate in Solid and Solution States | Chem. Commun. | 48 | 717-719 | 2012 |
| 7. | Rotti Srinivasamurthy Swathi & K. L. Sebastian | Excitation Energy Transfer from Dye Molecules to Doped Graphene | J. Chem. Sci. | 124 | 233-240 | 2012 |
| 6. | Rotti Srinivasamurthy Swathi & K. L. Sebastian | Excitation Energy Transfer from a Fluorophore to Single-walled Carbon Nanotubes | J. Chem. Phys. | 132 | 104502 | 2010 |
| 5. | Rotti Srinivasamurthy Swathi & K. L. Sebastian | Distance Dependence of Fluorescence Resonance Energy Transfer | J. Chem. Sci. | 121 | 777 | 2009 |
| 4. | Rotti Srinivasamurthy Swathi & K. L. Sebastian | Long-range Resonance Energy Transfer from a Dye Molecule to Graphene has (distance)-4 Dependence | J. Chem. Phys. | 131 | 086101 | 2009 |
| 3. | Rotti Srinivasamurthy Swathi & K. L. Sebastian | Resonance Energy Transfer from a Dye Molecule to Graphene | J. Chem. Phys. | 129 | 054703 | 2008 |
| 2. | Rotti Srinivasamurthy Swathi & K. L. Sebastian | Resonance Energy Transfer from a Fluorescent Dye Molecule to Plasmon and Electron-hole Pair Excitations of a Metal Nanoparticle | J. Chem. Phys. | 126 | 234701 | 2007 |
| 1. | Panchanan Puzari, Rotti Srinivasamurthy Swathi, Biplab Sarkar & Satrajit Adhikari | A Quantum-Classical Approach to the Photoabsorption Spectrum of Pyrazine | J. Chem. Phys. | 123 | 134317 | 2005 |