Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches

Phyto-mediated nanoparticles (NPs) are known for their high biocompatibility, eco-friendliness, and cost-effectiveness, and they have been gaining significant attention recently. Here, we present a unique method for synthesizing zinc oxide nanoparticles (ZnO NPs) using Datura metel L. leaf extract a...

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Main Authors: Uday Sankar Senapati, Priya Chauhan, Harshita Kalita, Apurba Das, Jyotshna Saikia, Madhurima Goswami, Himangshu Deka, Tupu Barman
Format: Article
Language:English
Published: Elsevier 2025-01-01
Series:Next Nanotechnology
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Online Access:http://www.sciencedirect.com/science/article/pii/S2949829525000634
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author Uday Sankar Senapati
Priya Chauhan
Harshita Kalita
Apurba Das
Jyotshna Saikia
Madhurima Goswami
Himangshu Deka
Tupu Barman
author_facet Uday Sankar Senapati
Priya Chauhan
Harshita Kalita
Apurba Das
Jyotshna Saikia
Madhurima Goswami
Himangshu Deka
Tupu Barman
author_sort Uday Sankar Senapati
collection DOAJ
description Phyto-mediated nanoparticles (NPs) are known for their high biocompatibility, eco-friendliness, and cost-effectiveness, and they have been gaining significant attention recently. Here, we present a unique method for synthesizing zinc oxide nanoparticles (ZnO NPs) using Datura metel L. leaf extract as capping and reducing agents followed by characterization with X-ray diffraction (XRD), field emission electron microscopy (FESEM), transmission electron microscope (TEM), Fourier transform infrared spectroscopy (FTIR) and UV–vis spectroscopy. XRD and TEM confirmed the formation of ZnO NPs. XRD reported a decrease in crystallite size from 32.9 to 26.5 nm, with strain proportionately increasing from 3.6 × 10−3 to 4.7 × 10−3. FESEM elucidated the morphology of the NPs and agglomeration was clear in the micrographs. FTIR identified the functional groups in the Datura metel L. leaf extract and supported the extract's qualitative phytochemical analysis. UV–vis spectroscopy confirmed the optical band gap of ZnO NPs (Eg∼3.98–4.03 eV), further validated by the density function theory (DFT), computed HOMO-LUMO energy gap values. The bacterial isolates extracted from spoiled fruits and vegetables examined using tube techniques and congo red agar (CRA) for analysing phenotypic biofilm formation capability. ZnO NPs exhibited strong anti-biofilm activity against the primary biofilm-forming isolate - Klebsiella pneumoniae. Hence, this investigation demonstrated that the green synthesized ZnO NPs using Datura metel L. leaf extract promise to serve as an antibacterial reagent to avert the microbial spoilage of fruits and vegetables.
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spelling doaj-art-a47f1eb431b146cabbcb4b96390dff752025-08-20T02:10:03ZengElsevierNext Nanotechnology2949-82952025-01-01710019410.1016/j.nxnano.2025.100194Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approachesUday Sankar Senapati0Priya Chauhan1Harshita Kalita2Apurba Das3Jyotshna Saikia4Madhurima Goswami5Himangshu Deka6Tupu Barman7Department of Physics, Handique Girls’ College, Guwahati, Assam 781001, India; Corresponding author.Advanced Level Institutional Biotech Hub, Handique Girls’ College, Guwahati, Assam 781001, IndiaAdvanced Level Institutional Biotech Hub, Handique Girls’ College, Guwahati, Assam 781001, IndiaDepartment of Physics, Handique Girls’ College, Guwahati, Assam 781001, IndiaDepartment of Physics, Handique Girls’ College, Guwahati, Assam 781001, IndiaDepartment of Microbiology, Handique Girls’ College, Guwahati, Assam 781001, IndiaBiochemistry Department, Tocklai Tea Research Institute, Jorhat, Assam 785008, IndiaTea Research Association, Upper Assam Advisory Centre, Dikom, Assam 786101, IndiaPhyto-mediated nanoparticles (NPs) are known for their high biocompatibility, eco-friendliness, and cost-effectiveness, and they have been gaining significant attention recently. Here, we present a unique method for synthesizing zinc oxide nanoparticles (ZnO NPs) using Datura metel L. leaf extract as capping and reducing agents followed by characterization with X-ray diffraction (XRD), field emission electron microscopy (FESEM), transmission electron microscope (TEM), Fourier transform infrared spectroscopy (FTIR) and UV–vis spectroscopy. XRD and TEM confirmed the formation of ZnO NPs. XRD reported a decrease in crystallite size from 32.9 to 26.5 nm, with strain proportionately increasing from 3.6 × 10−3 to 4.7 × 10−3. FESEM elucidated the morphology of the NPs and agglomeration was clear in the micrographs. FTIR identified the functional groups in the Datura metel L. leaf extract and supported the extract's qualitative phytochemical analysis. UV–vis spectroscopy confirmed the optical band gap of ZnO NPs (Eg∼3.98–4.03 eV), further validated by the density function theory (DFT), computed HOMO-LUMO energy gap values. The bacterial isolates extracted from spoiled fruits and vegetables examined using tube techniques and congo red agar (CRA) for analysing phenotypic biofilm formation capability. ZnO NPs exhibited strong anti-biofilm activity against the primary biofilm-forming isolate - Klebsiella pneumoniae. Hence, this investigation demonstrated that the green synthesized ZnO NPs using Datura metel L. leaf extract promise to serve as an antibacterial reagent to avert the microbial spoilage of fruits and vegetables.http://www.sciencedirect.com/science/article/pii/S2949829525000634Green synthesisZinc Oxide nanoparticlesStructure elucidationBand gapPhytochemical analysisAntibiofilm activity
spellingShingle Uday Sankar Senapati
Priya Chauhan
Harshita Kalita
Apurba Das
Jyotshna Saikia
Madhurima Goswami
Himangshu Deka
Tupu Barman
Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches
Next Nanotechnology
Green synthesis
Zinc Oxide nanoparticles
Structure elucidation
Band gap
Phytochemical analysis
Antibiofilm activity
title Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches
title_full Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches
title_fullStr Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches
title_full_unstemmed Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches
title_short Green synthesis, characterization and bioactivity of zinc oxide nanoparticles: Experimental and computational approaches
title_sort green synthesis characterization and bioactivity of zinc oxide nanoparticles experimental and computational approaches
topic Green synthesis
Zinc Oxide nanoparticles
Structure elucidation
Band gap
Phytochemical analysis
Antibiofilm activity
url http://www.sciencedirect.com/science/article/pii/S2949829525000634
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