PUBLICATIONS
Research Publications: (Click on DOI for Journal link)
Total Impact Factor = 273.062 Average Impact factor per paper = 5.461
Google Scholar: AzcX9PUAAAAJ (Total Citations > 1,700; h-index=20)
55. B. Prusti, S. Tripathi, P. Sivasakthi, P. K. Samanta, and M. Chakravarty, “Isomeric benzenediol-linked organophosphonates as a handy reusable emitting platform: Diversity in polyamine vapor detection.” (Submitted 2024)
54. S. Bhuin, P. Chakraborty, P. Sivasakthi, P. K. Samanta, P. Yogeeswari, and M. Chakravarty, “Heteroatom-Tuned Biocompatible Fluorophores for Discerning Live Cancer Cells through Lipid Droplet Bioimaging: From Design Concept to Biological Pursuit.” (Submitted 2024)
53. N. P. S. Kothoori, P. Sivasakthi, M. Baithy and P. K. Samanta*, “Theoretical Insights into the Phosphorescence and Excited State Properties of Cyclometalated Pt(II) and Pd(II) Complexes.” (To Be Submitted 2024)
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2024
52. P. Sivasakthi and P. K. Samanta*, “Unveiling the Photophysical and Excited State Properties of Multi-Resonant OLED Emitters using Combined DFT and CCSD Method.” Phys. Chem. Chem. Phys., xx (xx), xxx-xxx (2024). DOI: (IF=3.3)
51. N. P. S. Kothoori, P. Sivasakthi, M. Baithy, R. Misra and P. K. Samanta*, “Rational Design and Investigation of Nonlinear Optical Response Properties of Pyrrolopyrrole Aza-BODIPY-Based Novel Push-Pull Chromophore.” RSC Adv., 14 (22), 15560-15570 (2024). DOI: 10.1039/D4RA02861A (IF=3.9)
50. S. Khan, S. Chand, P. Sivasakthi, P. K. Samanta, and C. Chakraborty, “A Highly Robust and Conducting Ultramicroporous 3D Fe(II) based Metal-Organic Framework for Efficient Energy Storage.” Small, xx (xx), xxx-xxx (2024). DOI: 10.1002/smll.202401102 (IF=13.3)
49. A. Jain, P. Sivasakthi, P. K. Samanta, and M. Chakravarty, “Isomeric benzenediol-linked organophosphonates as a handy reusable emitting platform: Diversity in polyamine vapor detection.” J. Org. Chem., 89 (7), 4384-4394 (2024). DOI: 10.1021/acs.joc.3c02490 (IF=3.6)
48. M. Chakraborty, P. Sivasakthi, P. K. Samanta, and M. Chakravarty, “Concentration-tuned diverse response to selective biogenic amines using a reusable fluorophore: monitoring protein-rich food spoilage.” J. Mater. Chem. B, 12 (11), 2746-2760 (2024). DOI: 10.1039/d3tb02569a (IF=7.0)
47. P. C. Meenu, P. K. Samanta, S. P. Datta, S. A. Singh, S. Dinda, C. Chakraborty and S. Roy, “Electro-oxidation Reaction of Methanol over La2-xSrxNi1-y(Mn/Fe/Co)yO4+δ Ruddlesden-Popper oxides.” Inorg. Chem., 63 (1), 526-536 (2024). DOI: 10.1021/acs.inorgchem.3c03429 (IF=4.6)
46. B. Prusti, S. Tripathi, P. K. Samanta, and M. Chakravarty, “Vinylene-Linked Conjugated Microporus Polymer Decorated with Electron-Rich Units: A Single-Component White Light Emitting Device.” Adv. Opt. Mater., 12 (5), 2301746 (2024). DOI: 10.1002/adom.202301746 (IF=9.0)
2023
45. P. Sivasakthi and P. K. Samanta*, “Exploring Thioxanthone Derivatives as Singlet Oxygen Photosensitizers for Photodynamic Therapy at Near-IR Region.” J. Phys. Chem. A, 127 (42), 8900-8910 (2023). DOI: 10.1021/acs.jpca.3c05780 (IF=2.9)
44. N. P. S. Kothoori, P. Sivasakthi, and P. K. Samanta*, “Theoretical Insights into the Room Temperature Phosphorescence Properties in Star-Shaped Carbazole Based Molecules.” New J. Chem., 47 (32), 15193-15200 (2023) DOI: 10.1039/D3NJ01537H (IF=3.3)
43. S. Bhuin, P. Chakraborty, P. Sivasakthi, P. K. Samanta, P. Yogeeswari, and M. Chakravarty, “Asymmetrical Organic D-π-A Conjugate with ‘V’-Shaped Crystal Packing: Quest to transcend the limits of photophysical properties and applications.” J. Mater. Chem. C, 11 (33), 11270-11282 (2023). DOI: 10.1039/D3TC01793A (IF=8.067)
42. S. Halder, A. K. Pradhan, P. Sivasakthi, P. K. Samanta, and C. Chakraborty, “Engineering S, N-doped Carbon Nanosheets Derived from Thiazolothiazole-based Conjugated Polymer for Efficient Electrocatalytic Oxygen Evolution and Zn-air Battery.” Mater. Today Chem., 32, 101649 (2023). DOI: 10.1016/j.mtchem.2023.101649 (IF=7.613)
41. S. Bhuin, P. Chakraborty, P. Sivasakthi, P. K. Samanta, and M. Chakravarty, “Double site twisted D-π-D' conjugates with versatile photophysical facets for diverse optical applications and wash-free bioimaging of cancer cell.” ACS Appl. Opt. Mater., 1 (7), 1289-1300 (2023). DOI: 10.1021/acsaom.3c00144
40. J. M. Jacob, P. K. Samanta, and M. K. Ravva, “Computational Design of Efficient Near-Infrared TADF Emitters with Hot-Exciton Characteristic.” New J. Chem., 47 (22), 10552-10563 (2023) DOI: 10.1039/D3NJ01955A (IF=3.3)
39. S. Halder, S. Pal, P. Sivasakthi, P. K. Samanta and C. Chakraborty, “A Thiazolothiazole Containing Conjugated Polymer with Electrochromism and Electrofluorochromism Based Dual Performance for Flip-Flop Molecular Logic Gate.” Macromolecules, 56 (6), 2319-2327 (2023). DOI: 10.1021/acs.macromol.2c01767 (IF=6.057)
38. B. Prusti, S. Tripathi, P. Sivasakthi, P. K. Samanta and M. Chakravarty, “Solution and Solid-State Emissive Organophosphonates with High-Contrast Reversible Mechanofluorochromism: Beyond the classical frameworks.” ACS Appl. Opt. Mater., 1 (4), 889-897 (2023). DOI: 10.1021/acsaom.3c00047
37. P. Sivasakthi, J. M. Jacob, M. K. Ravva, and P. K. Samanta*, “Theoretical Insights into the Optical and Excited State Properties of Donor-Phenyl bridge-Acceptor Containing Through Space Charge Transfer Molecules”. J. Phys. Chem. A, 127 (4), 886-893 (2023). DOI: 10.1021/acs.jpca.2c07055 (IF=2.9)
36. P. K. Samanta* and R. Mishra, “Intramolecular charge transfer for optical applications”. J. Appl. Phys., 133 (2), 020901 (2023). DOI: 10.1063/5.0131426 (IF=2.877)
2022
35. R. Grandhe; V. K. Katta, P. K. Samanta, N. K. Katari, N. J. English, D. P. Dutta and B. R. Ravuri, “Suitability and Performance of NaNi1-x(VO)xPO4 (x=0.1, 0.3 and 0.5) Mixed Polyanion Glass and Glass-Ceramic Cathodes for Na-ion Battery”. Mater. Sci. Eng. B, 285, 115938 (2022). DOI: 10.1016/j.mseb.2022.115938 (IF=3.407)
34. P. C. Meenu, P. K. Samanta, T. Yoshida, N. J. English, S. P. Datta, S. A. Singh, S. Dinda, C. Chakraborty and S. Roy, "Electro-oxidation Reaction of Methanol over La2-xSrxNiO4+δ Ruddlesden-Popper oxides." ACS Appl. Energy Mater., 5, 503-515 (2022). DOI: 10.1021/acsaem.1c03027 (IF=6.4)
33. N. Busschaert, D. Maity, P. K. Samanta, N. J. English and A. D. Hamilton, "Improving structural stability and anticoagulant activity of a thrombin binding aptamer by aromatic modifications." ChemBioChem, 23, e202100670 (2022). DOI: 10.1002/cbic.202100670 (IF=3.468)
32. S. Bhuin, P. K. Samanta, and M. Chakravarty, "Efficient and reversible acidofluorochromic features on a solid platform for reusable security writing: A structure-property relationship study on anthracenyl π-conjugates." Dyes Pigm., 197, 109944 (2022). DOI: 10.1016/j.dyepig.2021.109944 (IF=4.5)
31. V. N. Badavath, A. Kumar, P. K. Samanta, S. Maji, A. Das, G. Blum, A. Jha, and A. Sen, Determination of potential inhibitors based on isatin derivatives against SARS-CoV-2 main protease (mpro): a molecular docking, molecular dynamics and structure-activity relationship studies. J. Biomol. Struct. Dyn., 22, 3110-3128 (2022). DOI: 10.1080/07391102.2020.1845800 (IF = 5.235)
2021
30. B. Prusti, P. K. Samanta, N. J. English and M. Chakravarty, "C3-symmetric simple organic salt as efficient mechano-/thermo-responsive molecule: Reusable, sensitive and colorimetric fluorescent thermometer.", Chem. Commun., 57, 12321-12324 (2021). DOI: 10.1039/D1CC05599B (IF=4.9)
29. B. C. Garain, P. K. Samanta* and S. K. Pati, "Intersystem Crossing in Boron-Based Donor-Spiro-Acceptor Organic Chromophore: A Detailed Theoretical Study", J. Phys. Chem. A, 125 (31), 6674-6680 (2021). DOI: 10.1021/acs.jpca.1c03729 (IF=2.9)
28. M. Veronica Sofianos, J. Lee, D S. Silvester, P. K. Samanta, M. Paskevicius, N. J. English and C. E. Buckley, Diverse morphologies of zinc oxide nanoparticles and their electrocatalytic performance in hydrogen production. J. Energy Chem., 56, 162-170 (2021). DOI: 10.1016/j.jechem.2020.07.051 (IF = 13.1)
27. S. Ghosh, T. Atchuta Ramarao, P. K. Samanta, A. Jha, P. Satpati and A. Sen, Triazole Based Isatin Derivatives as Potential Inhibitor of Key Cancer promoting Kinases- Insight from Electronic Structure, Docking and Molecular Dynamics Simulations, J. Mol. Graph. Model., 107, 107944 (2021). DOI: 10.1016/j.jmgm.2021.107944 (IF=2.9)
2020
26. S. V. K. Isukapalli, R. S. Lekshmi, P. K. Samanta and S. R. Vennapusa, Formation of excited triplet states in naphthalene diimide and perylene diimide derivatives: A detailed theoretical study. J. Chem. Phys., 153, 124301 (2020). DOI:10.1063/5.0012476 (IF = 4.304)
25. P. K. Samanta* and N. J. English, "Triplet Harvesting Using Two-Photon Absorption in Substituted Naphthalimides for Their Applications as Heavy-Metal-Free Photosensitizers", J. Phys. Chem. C, 124 (15), 8178-8185 (2020). DOI: 10.1021/acs.jpcc.0c01290 (IF=3.7)
24. P. K. Samanta, C. J. Burnham and N. J. English, "Stability-Ranking of Crystalline Ice Polymorphs Using Density-Functional Theory", Crystals, 10 (1), 40 (2020). DOI: 10.3390/cryst10010040 (IF=2.7)
2019
23. S. Kuila, A. Ghorai, P. K. Samanta, R. B. K. Siram, S. K. Pati, K. S. Narayan and S. J. George, "Red-emitting Delayed Fluorescence and Room Temperature Phosphorescence from Core-substituted Naphthalene Diimides", Chem. Eur. J., 25 (70), 16007-16011 (2019). DOI: 10.1002/chem.201904651 (IF=4.3)
22. P. K. Samanta, M. M. Alam, R. Misra and S. K. Pati, "Tuning of hyperpolarizability, one- and two-photon absorption of donor-acceptor and donor-acceptor-acceptor-type intramolecular charge Transfer-based sensors", Phys. Chem. Chem. Phys., 21 (31), 17343-17355 (2019). DOI: 10.1039/C9CP03772A (IF=3.3)
21. P. K. Samanta and N. J. English, "Opto-Electronic Properties of Stable Blue Photosensitisers on a TiO2 Anatase-101 Surface for Efficient Dye-Sensitised Solar Cells", Chem. Phys. Lett., 731, 136624 (2019). DOI: 10.1016/j.cplett.2019.136624 (IF=2.8)
20. P. Acharyya, A. Sarkar, P. K. Samanta, P. Pal, S. K. Pati and K. Biswas, "Single Pot Synthesis of Indirect Band Gap 2D CsPb2Br5 Nanosheets from Direct Band Gap 3D CsPbBr3 Nanocrystals and the Origin of Their Luminescence Properties", Nanoscale , 11 (9), 4001-4007 (2019). DOI: 10.1039/C8NR09349K (IF=6.7)
2018
19. S. Kuila, K. V. Rao, S. Garain, P. K. Samanta, S. Das, S. K. Pati, M. Eswaramoorthy and S. J. George, "Aqueous Phase Phosphorescence: Ambient Triplet Harvesting of Purely Organic Phosphors via Supramolecular Scaffolding", Angew. Chem. Int. Ed. , 57 (52), 17115-17119 (2018). DOI: 10.1002/anie.201810823 (IF=16.6)
18. R. Haldar, S. Diring, P. K. Samanta, M. Muth, W. Clancy, A. Mazel, S. Schlabach, F. Kirschhoefer, G. Brenner- Weiss, S. K. Pati, F. Odobel and C. Wöll, "Enhancing Selectivity and Kinetics in Oxidative Photocyclization by Supramolecular Control", Angew. Chem. Int. Ed. , 57 (41), 13662-13665 (2018). DOI: 10.1002/anie.201806996 (IF=16.6)
17. K. Navamani, P. K. Samanta and S. K. Pati, "Theoretical Modeling of Charge Transport in Triphenylamine-Benzimidazole Based Organic Solids for Their Application as Host-Materials in Phosphorescent OLED", RSC Advances, 8 (52), 30021-30039 (2018). DOI: 10.1039/C8RA03281E (IF=3.9)
16. P. K. Samanta* and S. K. Pati, "Theoretical Insights into the Excited State Properties of Room Temperature Phosphorescence Emitting N-Substituted Naphthalimides", J. Mol. Model., 24, 246 (2018). DOI: 10.1007/s00894-018-3779-4 (IF=2.2)
2017
15. P. K. Samanta, D. Kim, V. Coropceanu and J.-L. Bredas, "Up-conversion Intersystem Crossing Rates in Organic Emitters for Thermally Activated Delayed Fluorescence: Impact of the Nature of Singlet vs Triplet Excited States" J. Am. Chem. Soc., 139 (11), 4042-4051 (2017). DOI: 10.1021/jacs.6b12124 (IF=15.0)
14. P. K. Samanta and S. K. Pati, "Understanding The Unfolding Mechanism of Human Telomeric G-quadruplex Using Steered Molecular Dynamics Simulation", Indian J. Chem. 56A (09): 907-912 (2017). DOI: 10.56042/ijca.v56i9.18383 (IF=0.412)
2016
13. R. Haldar, K. Prasad, P. K. Samanta, S. K. Pati and T. K. Maji, "Luminescent Metal-Organic Complexes of Pyrene or Anthracene Chromophores: Energy Transfer Assisted Amplified Exciplex Emission and Al3+ Sensing", Cryst. Growth Des. 16 (1): 82-91 (2016). DOI: 10.1021/acs.cgd.5b01448 (IF=3.8)
2015
12. N. Narayanaswamy, S. Das, P. K. Samanta, K. Banu, G. P. Sharma, N. Mondal, S. K. Dhar, S. K. Pati and T. Govindaraju, "Sequence-Specific Recognition of DNA Minor Groove by an NIR-Fluorescence Switch-On Probe and its potential applications", Nucleic Acids Res. 43 (18): 8651-8663 (2015). DOI: 10.1093/nar/gkv875 (IF=14.9)
11. S. Das, P. K. Samanta and S. K. Pati "Watson-Crick Base Pairing, Electronic and Photophysical Properties of Triazole Modified Adenine Analogues: A Computational Study", New J. Chem., 39 (12), 9249-9256 (2015). DOI: 10.1039/C5NJ01566A (IF=3.3)
10. P. K. Samanta and S. K. Pati, "Theoretical Understanding of Two-photon-induced Fluorescence of Isomorphic Nucleoside Analogs", Phys. Chem. Chem. Phys., 17 (15),10053-10058 (2015). DOI: 10.1039/C5CP00134J (IF=3.3)
2014
9. N. Narayanaswamy, M. Kumar, S. Das, R. Sharma, P. K. Samanta, S. K. Pati, S. K. Dhar, T. K. Kundu and T. Govindaraju, "A Thiazole Coumarin (TC) Turn-On Fluorescence Probe for AT-Base Pair Detection and Multipurpose Applications in Different Biological Systems", Sci. Rep., 4, 6476 (2014). DOI: 10.1038/srep06476 (IF=4.996)
8. D. Maity, R. Anand, P. K. Samanta, D. Karthigeyan, T. K. Kundu, S. K. Pati and T. Govindaraju, "A Probe for ratiometric near-infrared fluorescence and colorimetric hydrogen sulfide detection and imaging in live cells", RSC Adv., 4 (22),11147-11151 (2014). DOI: 10.1039/C4RA00401A (IF=3.9)
7. P. K. Samanta and S. K. Pati, "Structural and Magnetic Properties of a Variety of Transition Metal Incorporated DNA Double Helices", Chem. Eur. J., 20 (6), 1760-1764 (2014). DOI: 10.1002/chem.201302628 (IF=4.3)
2013
6. P. K. Samanta and S. K. Pati, "Structural, Electronic and Photophysical Properties of Analogous RNA Nucleosides: A Theoretical Study", New J. Chem., 37 (11), 3640-3646 (2013). DOI: 10.1039/C3NJ00633F (IF=3.3)
5. M. B. Avinash, P. K. Samanta, K. V. Sandeepa, S. K. Pati and T. Govindaraju, "Molecular Architectonics of Stereochemically Constrained pi–Complementary Functional Modules", Eur. J. Org. Chem., 2013 (26), 5838–5847 (2013). DOI: 10.1002/ejoc.201300677 (IF=2.8)
2012
4. S. Neihsial, G. Periyasamy, P. K. Samanta and S. K. Pati, "Understanding the Binding Mechanism of Various Chiral SWCNTs and ssDNA: A Computational Study", J. Phys. Chem. B, 116 (51), 14754-14759 (2012). DOI: 10.1021/jp305894c (IF=3.3)
3. P. K. Samanta, A. K. Manna and S. K. Pati, "Structural, Electrical and Optical Properties of Metallo Base-Pairs in Duplex DNA: A Theoretical Insight", Chem. Asian J., 7 (11), 2718-2728 (2012). DOI: 10.1002/asia.201200630 (IF=4.1)
2. P. K. Samanta, A. K. Manna and S. K. Pati, "Thieno Analogues of RNA Nucleosides: A Detailed Theoretical Study", J. Phys. Chem. B, 116 (26), 7618-7626 (2012). DOI: 10.1021/jp301752k (IF=3.3)
1. P. K. Samanta, G. Periyasamy, A. K. Manna and S. K. Pati, "Computational Studies on Structural and Optical Properties of Single-stranded DNA encapsulated Silver/Gold cluster", J. Mater. Chem., 22 (14), 6774 - 6781 (2012). DOI: 10.1039/C2JM16068D (IF=6.626)
*As corresponding author.
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