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Muhammad Haroon, Tashfeen Akhtar, Muhammad Khalid, Hasnain Mehmood, Muhammad Adnan Asghar, Tansir Ahamad, Sarfraz Ahmed & Ataualpa A. C. Braga. (2023) Synthesis, Spectroscopic and Quantum Chemical Studies of N-Pentylhydrazinylthiazole Derivatives. Polycyclic Aromatic Compounds 0:0, pages 1-22.
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Anoop Kumar Pandey, Vikas Baboo, Vijay Narayan Mishra, V. K. Singh & Apoorva Dwivedi. (2022) Comparative Study of Molecular Docking, Structural, Electronic, Vibrational Spectra and Fukui Function Studies of Thiadiazole Containing Schiff Base – A Complete Density Functional Study. Polycyclic Aromatic Compounds 42:1, pages 13-39.
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Bharti Mohan, Mukesh Choudhary, Gaurav Kumar, Shabbir Muhammad, Neeladri Das, Khushwant Singh, Abdullah G. Al-Sehemi & Santosh Kumar. (2020) An experimental and computational study of pyrimidine based bis-uracil derivatives as efficient candidates for optical, nonlinear optical, and drug discovery applications. Synthetic Communications 50:14, pages 2199-2225.
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B. Baroudi, K. Argoub, D. Hadji, A.M. Benkouider, K. Toubal, A. Yahiaoui & A. Djafri. (2020) Synthesis and DFT calculations of linear and nonlinear optical responses of novel 2-thioxo-3-N,(4-methylphenyl) thiazolidine-4 one. Journal of Sulfur Chemistry 41:3, pages 310-325.
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Anuj Tripathi & Chetti Prabhakar. (2019) Impact of heteroatom (S and N) position and change in central ring of anthracene with heterocyclic ring on charge transport and optical properties in anthratetrathiazole (ATTz). Journal of Sulfur Chemistry 40:4, pages 361-376.
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Hai Le Thi Hong, Thao Le Phuong, Thong Van Pham, Hue Minh Thi Nguyen & Luc Van Meervelt. (2023)
Unusual reaction of (
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Hasnain Mehmood, Tashfeen Akhtar, Muhammad Haroon, Muhammad Khalid, Ataualpa A.C. Braga, Simon Woodward, Saad M. Alshehri & Muhammad Adnan Asghar. (2023) Spectroscopic characterization and quantum-chemical analysis of hydrazinyl thiazol-4(5H)-one functionalized materials to predict their key electronic and non-linear optical behavior. Journal of Molecular Structure 1288, pages 135798.
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L. Fomekong Tsague, G.W. Ejuh, A. Teyou Ngoupo, Y. Tadjouteu Assatse, R.A. Yossa Kamsi, M.T. Ottou Abe & J.M.B. Ndjaka. (2023) Ab-initio and density functional theory (DFT) computational study of the effect of fluorine on the electronic, optical, thermodynamic, hole and electron transport properties of the circumanthracene molecule. Heliyon 9:9, pages e19647.
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Shabbir Muhammad. (2022) Symmetric vs. asymmetric: Which one is the better molecular configuration for achieving robust NLO response?. Journal of Molecular Graphics and Modelling 114, pages 108209.
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