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62 та иш

Иш: Preliminary study on degradation mechanisms of plasma-treated DR1 by atomistic simulations

  1. DFTB+, a software package for efficient approximate density functional theory based atomistic simulations

    B. Hourahine, Bálint Aradi, Volker Blüm +36

    Мақола202014 иқтибос
    ABI

  2. Self-consistent-charge density-functional tight-binding method for simulations of complex materials properties

    Marcus Elstner, D. Porezag, G. Jungnickel +5

    Мақола199812 иқтибос
    ABI

  3. Parameterization of the DFTB3 Method for Br, Ca, Cl, F, I, K, and Na in Organic and Biological Systems

    Maximilian Kubillus, Tomáš Kubař, Michael Gaus +2

    Мақола20149 иқтибос
    ABI

  4. Parameterization of DFTB3/3OB for Sulfur and Phosphorus for Chemical and Biological Applications

    Michael Gaus, Xiya Lu, Marcus Elstner +1

    Мақола20149 иқтибос
    ABI

  5. Parametrization and Benchmark of DFTB3 for Organic Molecules

    Michael Gaus, Albrecht Goez, Marcus Elstner

    Мақола20128 иқтибос
    ABI

  6. DFTB+, a Sparse Matrix-Based Implementation of the DFTB Method

    Bálint Aradi, B. Hourahine, Thomas Frauenheim

    Мақола20078 иқтибос
    ABI

  7. Molecular understanding of the possible mechanisms of oligosaccharide oxidation by cold plasma

    Maksudbek Yusupov, Debbie Dewaele, Pankaj Attri +3

    МақолаPlasma Applications and DiagnosticsPlasma Processes and Polymers20228 иқтибос
    ABI

  8. Low-Temperature Plasma for Biology, Hygiene, and Medicine: Perspective and Roadmap

    Mounir Laroussi, Sander Bekeschus, Michael Keidar +17

    МақолаPlasma Applications and DiagnosticsIEEE Transactions on Radiation and Plasma Medical Sciences20216 иқтибос
    ABI

  9. The fate of plasma-generated oxygen atoms in aqueous solutions: non-equilibrium atmospheric pressure plasmas as an efficient source of atomic O<sub>(aq)</sub>

    Jan Benedikt, Mohamed Mokhtar Hefny, Alexander Shaw +4

    Мақола20186 иқтибос
    ABI

  10. Wastewater Treatment by Advanced Oxidation Process and Their Worldwide Research Trends

    José Antonio Garrido-Cárdenas, Belén Esteban-García, Ana Agüera +2

    Мақола20195 иқтибос
    ABI

  11. The 2017 Plasma Roadmap: Low temperature plasma science and technology

    Igor Adamovich, Scott Baalrud, Annemie Bogaerts +35

    Мақола20173 иқтибос
    ABI

  12. Reactive Molecular Dynamics Simulation of Fullerene Combustion Synthesis: ReaxFF vs DFTB Potentials

    Hu‐Jun Qian, Adri C. T. van Duin, Keiji Morokuma +1

    Мақола20113 иқтибос
    ABI

  13. An approximate DFT method for QM/MM simulations of biological structures and processes

    Marcus Elstner, Thomas Frauenheim, Sándor Suhai

    Мақола20033 иқтибос
    ABI

  14. Atmospheric plasma generates oxygen atoms as oxidizing species in aqueous solutions

    Mohamed Mokhtar Hefny, Cédric Pattyn, Petr Lukeš +1

    Мақола20163 иқтибос
    ABI

  15. Applications of Cold Atmospheric Pressure Plasma Technology in Medicine, Agriculture and Food Industry

    Mária Domonkos, Petra Tichá, Jan Trejbal +1

    Мақола20213 иқтибос
    ABI

  16. Review on discharge Plasma for water treatment: mechanism, reactor geometries, active species and combined processes

    Hichem Zeghioud, Phuong Nguyen‐Tri, Lotfi Khezami +2

    Мақола20203 иқтибос
    ABI

  17. Construction of tight-binding-like potentials on the basis of density-functional theory: Application to carbon

    D. Porezag, Thomas Frauenheim, Th. Köhler +2

    Мақола19953 иқтибос
    ABI

  18. Water Purification by Plasmas: Which Reactors are Most Energy Efficient?

    Muhammad Arif Malik

    Мақола20092 иқтибос
    ABI

  19. Recent developments in hazardous pollutants removal from wastewater and water reuse within a circular economy

    Menatalla Ahmed, Musthafa O. Mavukkandy, Adewale Giwa +5

    Мақола20222 иқтибос
    ABI

  20. Electrohydraulic Discharge and Nonthermal Plasma for Water Treatment

    Bruce R. Locke, Masayuki Sato, P. Šunka +2

    Мақола20052 иқтибос
    ABI

  21. Various Approaches for the Detoxification of Toxic Dyes in Wastewater

    Abdulmohsen Khalaf Dhahi Alsukaibi

    Мақола20222 иқтибос
    ABI

  22. Calculations of molecules, clusters, and solids with a simplified LCAO-DFT-LDA scheme

    Gotthard Seifert, D. Porezag, Thomas Frauenheim

    Мақола19962 иқтибос
    ABI

  23. Selective reactive oxygen and nitrogen species production in plasma-activated water via dielectric barrier discharge reactor: An innovative method for tuning and its impact on dye degradation

    Saeed Kooshki, Pankaj Pareek, Mário Janda +1

    Мақола20242 иқтибос
    ABI

  24. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  25. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI