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Dr Afifa Yousuf

Government Sadiq College Women University Bahawalpur

Pakistan

Northeast Normal University - College of Chemistry

Changchun, 130024

China

SCHOLARLY PAPERS

5

DOWNLOADS

751

TOTAL CITATIONS

0

Ideas:
“  Energy Storage, MOF, Sensors  ”

Scholarly Papers (5)

1.

H-Migration Effect on Aromaticity, Spectroscopic Behavior and Robust Nlo Response of the Pyrazine Based Push Pull Chromophores

Number of pages: 30 Posted: 02 Sep 2024
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, Government Sadiq College Women University Bahawalpur, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and Northeast Normal University
Downloads 217 (351,440)

Abstract:

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Proton-migration, Aromaticity, First hyperpolarizability, DFT, TD-DFT, Spectroscopy

2.

Reactivity, Stability, Thermodynamics, and Igm-Hirshfeld Surface Analysis of Sulfonium, Phosphonium, and Ammonium Based Ionic Liquids: Density Functional Theory Exploration

Number of pages: 45 Posted: 15 Aug 2024
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, Government Sadiq College Women University Bahawalpur, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, Northeast Normal University and King Khalid University
Downloads 214 (356,192)

Abstract:

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Ionic liquids, Density functional theory, Thermodynamics, Hirshfeld Surface, AIM

3.

Spectroscopic Studies and Non-Linear Optical Response Through C/N Replacement and Modulation of Electron Donor/Acceptor Units on Naphthyridine Derivatives

Number of pages: 37 Posted: 17 Oct 2024
affiliation not provided to SSRN, Government Sadiq College Women University Bahawalpur and affiliation not provided to SSRN
Downloads 155 (485,678)

Abstract:

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Naphthyridine, Pyrrole-Pyridine, Density Functional Theory, Non-linear Optical Properties, TD-DFT

4.

Deciphering the Role of Flutamide, Fluorouracil, and Furomollugin Based Ionic Liquids in Potent Anticancer Agents: Quantum Chemical, Medicinal, Molecular Docking and Md Simulation Studies

Number of pages: 56 Posted: 02 Oct 2024
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, Government Sadiq College Women University Bahawalpur, affiliation not provided to SSRN, affiliation not provided to SSRN and Northeast Normal University
Downloads 115 (621,896)

Abstract:

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Ionic liquids, Hirshfeld analysis, AIM, Anti-Cancer, ADME, Molecular Docking, MD simulation

5.

Synthesis, Spectral Characterization, Electron Localization Function, Density of State, and Electro-Optical Properties of Cyanoacrylamide Derived Knoevenagel Adducts

Number of pages: 33 Posted: 01 Nov 2024
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, Government Sadiq College Women University Bahawalpur, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 50 (1,109,210)

Abstract:

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Synthesis, Spectroscopy, Hyperpolarizability, Density of State, Frontier molecular orbitals, Electron localized function