Research Papers By Author

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Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Electronic structure of polylthiophene gas sensors for chlorinated analytes. Ayesha Ashraf, Umar Farooq, Bilal Ahmed Farooqi and Khurshid Ayub*, Journal of Molecular Modeling, 2020,

International ,Journal ,SPRINGER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Zinc-Doped Boron Phosphide Nanocluster as Efficient Sensor for SO

International ,Journal ,Hindawi ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Exceptional NLO response and deep ultraviolet transparency of superalkalis doped macrocyclic oligofuran

International ,Journal ,Cell Press ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Theoretical investigation on radical anion promoted electrocyclization in photochromes

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Permeation selectivity of alkali metal ions through crown ether based ion channels

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Cyclic versus straight chain oligofuran as sensor: A detailed DFT study

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Synergic effect of pore size engineering and an applied electric field on the controlled permeation of alkali metal atoms and ions across pristine and defect-containing h-BN sheets

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Theoretical study on novel superalkali doped graphdiyne complexes: Unique approach for the enhancement of electronic and nonlinear optical response

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
High selectivity of cyclic tetrapyrrole over tetrafuran and tetrathiophene toward toxic chemicals; A first-principles study

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Designing alkoxy-induced based high performance near infrared sensitive small molecule acceptors for organic solar cells

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Expanding the horizons of covalent organic frameworks to electrochemical sensors; A case study of CTF-FUM

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Adsorption of Phosgene Gas on Pristine and Copper-Decorated B12N12 Nanocages: A Comparative DFT Study

International ,Journal ,ACS OMEGA ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Outstanding NLO response of thermodynamically stable single and multiple alkaline earth metals doped C20 fullerene

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Silver-graphene quantum dots based electrochemical sensor for trinitrotoluene and p-nitrophenol

International ,Journal ,ELSEVIER ,2020
Khurshid Ayub
Associate Professor , Chemistry Department,
Abbottabad Campus
Enhancement in Photovoltaic Properties of N,N-diethylaniline based Donor Materials by Bridging Core Modifications for Efficient Solar Cells

International ,Journal ,WILEY ,2020
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