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(ZnO)42 nanocluster: a novel visibly active magic quantum dot under first principle investigation

Theoretical chemistry accounts, 2023-02, Vol.142 (2), Article 19

2023

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Optical activity of Co-porphyrin in the light of IR and Raman spectroscopy: A critical DFT investigation

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2018-02, Vol.190, p.121-128

2018

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Green Synthesis of Triangular ZnO Nanoparticles Using Azadirachta indica Leaf Extract and Its Shape Dependency for Significant Antimicrobial Activity: Joint Experimental and Theoretical Investigation

Journal of cluster science, 2022-11, Vol.33 (6), p.2517-2530

2022

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Hexagonal thallium nitride in (TlX)2n+1H2n+4 [X = N, P, As; n = 1–5] cluster series: A promising building motif for future smart nanomaterials

Materials chemistry and physics, 2017-10, Vol.200, p.368-375

2017

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Green Synthesis of Dense Rock MgO Nanoparticles Using Carica Papaya Leaf Extract and its Shape Dependent Antimicrobial Activity: Joint Experimental and DFT Investigation

Journal of cluster science, 2022-07, Vol.33 (4), p.1667-1675

2022

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Structure, electronic, optical and thermodynamic behavior on the polymerization of PMMA: A DFT investigation

Computational biology and chemistry, 2018-02, Vol.72, p.192-198

2018

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A comparative DFT study on electronic, thermodynamic and optical properties of telluride compounds

Computational materials science, 2014-06, Vol.88, p.156-162

2014

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Density functional investigation on hexagonal nanosheets and bulk thallium nitrides for possible thermoelectric applications

Applied nanoscience, 2019-02, Vol.9 (1), p.33-42

2019

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Magnetic switching in Crx (x = 2–8) and its oxide cluster series

Journal of magnetism and magnetic materials, 2018-04, Vol.451, p.32-37

2018

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Magnetic switching in Cr^sub x^ (x?=?2–8) and its oxide cluster series

Journal of magnetism and magnetic materials, 2018-04, Vol.451, p.32

2018

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Magnetic switching in Cr (x = 2–8) and its oxide cluster series

Journal of magnetism and magnetic materials, 2018-04, Vol.451, p.32-37

2018

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Hexagonal thallium nitride in (TlX) 2n+1 H 2n+4 [X = N, P, As; n = 1–5] cluster series: A promising building motif for future smart nanomaterials

Materials chemistry and physics, 2017-10, Vol.200, p.368-375

2017

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Sc3N and Sc2C2 encapsulated B40: Smarter than its carbon analogue

Physica. E, Low-dimensional systems & nanostructures, 2016-10, Vol.84, p.354-360

2016

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(ZnO)60: a UV Active Magic Nanocluster under DFT Study

Biointerface Research in Applied Chemistry, 2023-04, Vol.13 (2), p.196

2023

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Sc 3 N and Sc 2 C 2 encapsulated B 40 : Smarter than its carbon analogue

Physica. E, Low-dimensional systems & nanostructures, 2016-10, Vol.84, p.354-360

2016

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Structure, electronic properties, aromaticity and dynamics of M3N@C80 and M2C2@C82 (M=Sc, Y): A density functional study

Physica. E, Low-dimensional systems & nanostructures, 2015-06, Vol.70, p.157-164

2015

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DFT investigation on A4B4 (A=Cu, Ag; B=As, Sn) metal–semiconductor alloy clusters for potential nanomaterials

Physica. E, Low-dimensional systems & nanostructures, 2015-04, Vol.68, p.224-231

2015

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Density Functional Investigation on M3N@C80 and M2C2@C82 (M = Sc, Y)

Chemical Functionalization of Carbon Nanomaterials, 2016, p.360-367

2016

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hSSB1 (NABP2/OBFC2B) modulates the DNA damage and androgen‐induced transcriptional response in prostate cancer

The Prostate, 2023-05, Vol.83 (7), p.628-640

2023

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An Exploration of Small Molecules That Bind Human Single-Stranded DNA Binding Protein 1

Biology (Basel, Switzerland), 2023-11, Vol.12 (11), p.1405

2023

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Synthesis and Study of Photophysical Properties of 6,12‐Dicyano‐9‐oxa[7]helicene

ChemistrySelect (Weinheim), 2021-12, Vol.6 (47), p.13514-13519

2021

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Modulation of the Association Between Age and Death by Risk Factor Burden in Critically Ill Patients With COVID-19

Critical care explorations, 2022-09, Vol.4 (9), p.e0755

2022

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(ZnO)42 nanocluster: a novel visibly active magic quantum dot under first principle investigation

Optical activity of Co-porphyrin in the light of IR and Raman spectroscopy: A critical DFT investigation

Green Synthesis of Triangular ZnO Nanoparticles Using Azadirachta indica Leaf Extract and Its Shape Dependency for Significant Antimicrobial Activity: Joint Experimental and Theoretical Investigation

Hexagonal thallium nitride in (TlX)2n+1H2n+4 [X = N, P, As; n = 1–5] cluster series: A promising building motif for future smart nanomaterials

Green Synthesis of Dense Rock MgO Nanoparticles Using Carica Papaya Leaf Extract and its Shape Dependent Antimicrobial Activity: Joint Experimental and DFT Investigation

Structure, electronic, optical and thermodynamic behavior on the polymerization of PMMA: A DFT investigation

A comparative DFT study on electronic, thermodynamic and optical properties of telluride compounds

Density functional investigation on hexagonal nanosheets and bulk thallium nitrides for possible thermoelectric applications

Magnetic switching in Crx (x = 2–8) and its oxide cluster series

Magnetic switching in Cr^sub x^ (x?=?2–8) and its oxide cluster series

Magnetic switching in Cr (x = 2–8) and its oxide cluster series

Hexagonal thallium nitride in (TlX) 2n+1 H 2n+4 [X = N, P, As; n = 1–5] cluster series: A promising building motif for future smart nanomaterials

Sc3N and Sc2C2 encapsulated B40: Smarter than its carbon analogue

(ZnO)60: a UV Active Magic Nanocluster under DFT Study

Sc 3 N and Sc 2 C 2 encapsulated B 40 : Smarter than its carbon analogue

Structure, electronic properties, aromaticity and dynamics of M3N@C80 and M2C2@C82 (M=Sc, Y): A density functional study

DFT investigation on A4B4 (A=Cu, Ag; B=As, Sn) metal–semiconductor alloy clusters for potential nanomaterials

Density Functional Investigation on M3N@C80 and M2C2@C82 (M = Sc, Y)

hSSB1 (NABP2/OBFC2B) modulates the DNA damage and androgen‐induced transcriptional response in prostate cancer

An Exploration of Small Molecules That Bind Human Single-Stranded DNA Binding Protein 1

Synthesis and Study of Photophysical Properties of 6,12‐Dicyano‐9‐oxa[7]helicene

Modulation of the Association Between Age and Death by Risk Factor Burden in Critically Ill Patients With COVID-19

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