Showing 621 - 640 results of 10,659 for search '"theoretical"', query time: 0.12s Refine Results
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    Education, Quality and the Digital Transformation by N. E. Serditova, A. V. Belotserkovsky

    Published 2020-05-01
    Subjects: “…crossdisciplinary fundamental theoretical core…”
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    Theoretical Calculations and Molecular Docking Analysis of 4-(2-(4-Bromophenyl)Hydrazineylidene)-3,5-Diphenyl-4H-Pyrazole Molecule by Ümit Yıldıko, Veysel Tahiroğlu, Mehmet Bağlan, Kenan Gören

    Published 2024-12-01
    “…The MP2 method was optimized for these theoretical calculations using DGDZVP and 6-311G(d,p) basis sets. …”
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    Based on theoretical design simultaneous analysis of multiple neonicotinoid pesticides in beeswax by deep eutectic solvents extraction combined with UHPLC-MS/MS by Guodong Mu, Sha Yan, Fei Pan, Haitao Xu, Xu Jing, Xiaofeng Xue

    Published 2025-01-01
    “…In this work, we determined Proline and Oxalic acid as a suitable deep eutectic solvent (DES) to extract neonicotinoids from beeswax through theoretical design and verification tests. Systematic molecular dynamics simulations confirmed that hydrogen bonding and van der Waals forces facilitate the migration of neonicotinoid pesticides from beeswax into the DES. …”
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    Theoretical Insight into the Spectral Characteristics of Fe(II)-Based Complexes for Dye-Sensitized Solar Cells—Part I: Polypyridyl Ancillary Ligands by Xiaoqing Lu, Shuxian Wei, Chi-Man Lawrence Wu, Ning Ding, Shaoren Li, Lianming Zhao, Wenyue Guo

    Published 2011-01-01
    “…We report herein a theoretical investigation on a series of polypyridyl Fe(II)-based complexes of FeL2(SCN)2, [FeL3]2+, [FeL′(SCN)3]-, [FeL′2]2+, and FeL′′(SCN)2 (L = 2,2′-bipyridyl-4,4′-dicarboxylic acid, L′ = 2,2′,2″-terpyridyl-4,4′,4″-tricarboxylic acid, L″ = 4,4‴-dimethyl-2,2′ : 6′,2″ :6″,2‴-quaterpyridyl-4′,4″-biscarboxylic acid) by density functional theory (DFT) and time-dependent DFT (TD-DFT). …”
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    A game-theoretic approach for analyzing the effects of revenue sharing contracts and consumer surplus on supply chain sustainability under government interventions by Zahra Ghayoumian, Morteza Rasti Barzoki, Mohammad-Ali Eghbali

    Published 2024-09-01
    “…Notably, this study, for the first time, integrates all three dimensions of sustainability—social, economic, and environmental—within a game-theoretic framework that includes government intervention and a revenue-sharing agreement between the retailer and the manufacturer.Findings: The modeling results demonstrated that incorporating consumer surplus enhances the profitability of both the government and the manufacturer. …”
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    Sulfasalazine as a Corrosion Inhibitor on Carbon Steel Metal Surfaces in Acidic Media Using the Hydrogen Evolution Method: Experimental and Theoretical Studies by Hadi Thamer Obaid, Muthanna Mahmood Mutar, Safaa Hussein Ali

    Published 2025-01-01
    “…The correlation between the theoretical and experimental results is discussed. The theoretical and experimental studies showed that SSZ is a good inhibitor as the maximum anti-corrosion activity was achieved at the highest concentration of the SSZ (1 × 10−3 M), and the lowest temperature used in the experiment.…”
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    A theoretical prediction for generating isolated attosecond pulse in water window utilizing instantaneous frequency change of two-color driving laser pulse by Masoumeh Dehghanian, Mohammad Sabaeian, Siamak Noorizadeh

    Published 2025-02-01
    “…Abstract This work reports on the theoretical generation of isolated soft-X ray 106 attosecond pulse within the water window spectral region, through interacting a chirped two-color femtosecond laser pulse with a hydrogen atom. …”
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    Recognizing and addressing burnout among healthcare workers in rural Nepal: a proof-of-concept study using Kern’s six-step theoretical framework by Raj Kumar Dangal, Eva Studer, Tula Krishna Gupta, Kristin Nguyen, Amit Suneja, Karuna Khadka, Shailina Bata Shrestha, Bibhav Acharya

    Published 2025-01-01
    “…Competency-focused interventions that are developed using theoretical frameworks can address this gap. Methods We used Kern’s framework of curriculum development to create, refine, and assess a theory-driven intervention tailored to the needs and constraints of rural healthcare workers in Nepal. …”
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