Showing 1 - 5 results of 5 for search '"Adsorption energies"', query time: 0.02s Refine Results
  1. 1
    Assessment of the potential and application of Be12O12 nanocage for removal of ciprofloxacin from water employing density functional theory

    Assessment of the potential and application of Be12O12 nanocage for removal of ciprofloxacin from water employing density functional theory by Qaisar Ali, Abdul Shakoor, Gul Rehman, Munir Ur Rehman, Momin Khan, Rashid Ahmad, Iftikhar Ahmad, Abdullah F. AlAsmari, Fawaz Alasmari

    Published 2025-01-01
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  2. 2
    Unveiling the influence mechanism of La alloy on the oxidation behavior of Cu contact materials: A combined experimental and density functional investigation

    Unveiling the influence mechanism of La alloy on the oxidation behavior of Cu contact materials: A combined experimental and density functional investigation by Bingtian Li, Zhenjie Guan, AnRan Li, Ziyao Chen, Weijian Li, Liang Zhen, Wenzhu Shao

    Published 2025-03-01
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  3. 3
    Adsorption of Mo and O at S-vacancy on ReS2 surface of ReS2/MoTe2 vdW heterointerface

    Adsorption of Mo and O at S-vacancy on ReS2 surface of ReS2/MoTe2 vdW heterointerface by Puneet Kumar Shaw, Jehan Taraporewalla, Sohaib Raza, Akash Kumar, Rimisha Duttagupta, Hafizur Rahaman, Dipankar Saha

    Published 2025-06-01
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  4. 4
    Theoretical Study of CO, NO, NO<sub>2</sub>, Cl<sub>2</sub>, and H<sub>2</sub>S Adsorption Interactions with PdO–Graphene Composites for Gas Sensor Applications

    Theoretical Study of CO, NO, NO<sub>2</sub>, Cl<sub>2</sub>, and H<sub>2</sub>S Adsorption Interactions with PdO–Graphene Composites for Gas Sensor Applications by Piumantha Samaranayake, Azeez Ahamed, Visal de Silva, Nadeesha Manohari Wickramage, Muhammad Raziq Rahimi Kooh, Roshan Thotagamuge

    Published 2024-12-01
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  5. 5
    The Architecture of BaTiO<sub>3</sub> Nanoparticles Synthesis via Temperature-Responsive for Improved Oil Recovery: A Molecular Dynamics Simulation and Core-Flooding Experimental Study

    The Architecture of BaTiO<sub>3</sub> Nanoparticles Synthesis via Temperature-Responsive for Improved Oil Recovery: A Molecular Dynamics Simulation and Core-Flooding Experimental S... by Surajudeen Sikiru, Hassan Soleimani, Amir Rostami, Leila Khodapanah

    Published 2024-12-01
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