AA
Atazaz Ahsin
University of Chinese Academy of Sciences, Chinese Academy of Sciences, Allama Iqbal Open University, COMSATS University Islamabad - Abbottabad Campus
Research areas: Chemistry · Inorganic Chemistry · Crystal structures of chemical compounds · Crystallography and molecular interactions · Nonlinear Optical Materials Research
0000-0002-2529-0273
Employment
- 2022 - 2025
Education
- 2022 - 2025
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Allama Iqbal Open University Bachelors of Education2020 - 2021
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COMSATS University Islamabad - Abbottabad Campus MS/Mphill2018 - 2020
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Hazara University MSC (2-year)2016 - 2018
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University of Azad Jammu and Kashmir Bachelor of science (BSC)2014 - 2016
Projects & Funding
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The Alliance of International Science Organizations (ANSO) University of Chinese Academy of Sciences
Publications (21)
- Improving excited-state dynamic properties with the help of metalide character and excess electrons: earlier transition-metal pairing with superalkali clusters Save
- Stacking interactions in stabilizing supramolecular assembly of M[9C]2M complexes: dynamic stability with remarkable nonlinear optical features Save
- XRD/DFT, Hirshfeld surface analysis and molecular modelling simulations for unfolding reactivity of newly synthesized vanillin derivatives: excellent optical, NLO and protein binding efficiency Save
- Theoretically designed M@diaza[2.2.2]cryptand complexes: the role of non-covalent interactions in promoting NLO properties of organic electrides Save
- X-ray Diffraction, Spectroscopy, Optical Properties, NPA, NBO, FMO, and Hirshfeld Surface Analyses of Two Newly Synthesized Piperidinium Ionic Liquids Save
- Transition metals based metalides TM-Janus-TM (where TM=Sc–Zn and Janus=F6C6H6); A theoretical study of nonconventional metalides with excellent static and dynamic nonlinear optical properties Save
- Geometric, Electronic, and Optoelectronic Properties of Carbon-Based Polynuclear C3O[C(CN)2]2M3 (where M = Li, Na, and K) Clusters: A DFT Study Save
- Synthesis, Crystal Growth, and Computational Investigation of New Tetrahydroisoquinoline Derivatives Potent against Molecule Nitric Oxide Synthases Save
- Synthesis, single crystal structure, NBO investigations, and Hirshfeld topology analysis of new ethyl-5,8-dimethyl-6-phenyl-(1H-pyrrol-1-yl)-6,7-dihydrothieno[2,3-c] isoquinoline-2-carboxylate Save
- Remarkable electronic and NLO properties of bimetallic superalkali clusters: a DFT study Save
- Theoretical investigation of lithium-based clusters Lin (where n = 3, 5, 7) with remarkable electronic and frequency-dependent NLO properties Save
- M@[12-crown-4] and M@[15-crown-5] where (M=Li, Na, and K); the very first examples of non-conventional one alkali metal-containing alkalides with remarkable static and dynamic NLO response Save
- Superalkali-based alkalides Li3O@[12-crown-4]M (where M= Li, Na, and K) with remarkable static and dynamic NLO properties; A DFT study Save
- Germanium-based superatom clusters as excess electron compounds with significant static and dynamic NLO response; a DFT study Save
- Extremely large static and dynamic nonlinear optical response of small superalkali clusters NM3M’ (M, M’=Li, Na, K) Save
- Adsorption mechanism of p- aminophenol over silver-graphene composite: A first principles study Save
- Zintl based superatom P7M2 (M=Li, Na, K & Be, Mg, Ca) clusters with excellent second and third-order nonlinear optical response Save
- Oxacarbon superalkali C3X3Y3 (X = O, S and Y = Li, Na, K) clusters as excess electron compounds for remarkable static and dynamic NLO response Save
- Theoretical investigation of superalkali clusters M2OCN and M2NCO (where M=Li, Na, K) as excess electron system with significant static and dynamic nonlinear optical response Save
- Alkaline earth metals serving as source of excess electron for alkaline earth metals to impart large second and third order nonlinear optical response; a DFT study Save