Search Results - "Sandhu, Qurat‐ul‐Ain"
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The effects of polar solvents on structural, electronic, and optical properties of organic dyes
Published in International journal of quantum chemistry (05-05-2022)“…This study reports first principles investigations on effects of polar solvents acetonitrile, acetone, water, ethanol, and methanol on the structural,…”
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Iodide Adsorption on Transition-Metal-Doped SiC Monolayers: A Density Functional Theory Based Bonding Analysis
Published in Journal of electronic materials (01-06-2021)“…The exploration of platinum-free counter electrode (CE) materials is a hot area of research related to dye-sensitized solar cells. This work reports the…”
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A TD-DFT study of optical properties of TiSiO4 clusters
Published in Optical and quantum electronics (2023)“…Time-Dependent Density functional based calculations were performed to investigate the electronic and optical properties of Ti 2 O 4 , Si 2 O 4 , and hybrid…”
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4
Review: Schiff base metal complexes as anti-inflammatory agents
Published in Journal of coordination chemistry (19-05-2023)“…Schiff bases (SB) have unique potential to bind metal ions for widespread applications, especially in the pharmacological industry. The condensation of primary…”
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