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42 ta ish

Ish: Projector augmented-wave method

  1. Methods of estimations of the band gap for kesterite Cu2ZnSnS(Se)4

    Damir Mamedov, Komiljon Yakubov, R.B. Bazarbaev +3

    MaqolaChalcogenide Semiconductor Thin FilmsMaterials Today Proceedings20200 iqtibos
    ABI

  2. Triggering the phase transition and capacity enhancement of Nb<sub>2</sub>O<sub>5</sub> for fast-charging lithium-ion storage

    Fei Shen, Zhongti Sun, Liang Zhao +9

    MaqolaAdvancements in Battery MaterialsJournal of Materials Chemistry A20210 iqtibos
    ABI

  3. Interfacial atomic Ni tetragon intercalation in a NiO<sub>2</sub>-to-Pd hetero-structure triggers superior HER activity to the Pt catalyst

    Haolin Li, Sheng Dai, Dinesh Bhalothia +3

    MaqolaElectrocatalysts for Energy ConversionJournal of Materials Chemistry A20210 iqtibos
    ABI

  4. Synergistic vacancy defects and mechanical strain for the modulation of the mechanical, electronic and optical properties of monolayer tungsten disulfide

    Chan Gao, Xiaoyong Yang, Ming Jiang +3

    Maqola2D Materials and ApplicationsPhysical Chemistry Chemical Physics20210 iqtibos
    ABI

  5. Enhanced photocatalytic performance of Ag nanoparticle–TiO<sub>2−<i>X</i></sub> nanotube arrays obtained by a predischarge–deposition method and calcination in H<sub>2</sub>/N<sub>2</sub>

    Qihang Liu, Junjun Chen, Lang Zhang +7

    MaqolaAdvanced Photocatalysis TechniquesReaction Chemistry & Engineering20230 iqtibos
    ABI

  6. Two-Dimensional High-Entropy Selenides for Boosting Visible-Light-Driven Photocatalytic Performance

    Jing Wang, Zhongliao Wang, Jinfeng Zhang +4

    MaqolaAdvanced Photocatalysis TechniquesACS Nano20240 iqtibos
    ABI

  7. Polytelluride square planar chain-induced anharmonicity results in ultralow thermal conductivity and high thermoelectric efficiency in Al<sub>2</sub>Te<sub>5</sub> monolayers

    Iraj Maleki, S. Mehdi Vaez Allaei, S. Shahab Naghavi

    MaqolaAdvanced Thermoelectric Materials and DevicesPhysical Chemistry Chemical Physics20240 iqtibos
    ABI

  8. Pressure-sensitive germanate glass-Li <sub>2</sub> GeO <sub>3</sub> , a multifunctional energy material: a theoretical study

    R. Zosiamliana, L. Celestine, Lalhriat Zuala +6

    MaqolaFerroelectric and Piezoelectric MaterialsHigh Pressure Research20240 iqtibos
    ABI

  9. Selenium-based hetero-circulene monolayer: Coexistence of gapped Dirac fermions, heavy fermions and semiconductivity in a single quantum platform with lithium-ion battery applications

    Naga Venkateswara Rao Nulakani, Yarjan Abdul Samad, Ameen Shahid +2

    Maqola2D Materials and ApplicationsJournal of Energy Storage20250 iqtibos
    ABI

  10. Experimental and DFT Investigation of Structural, Morphological, and Optical Properties of Sol–Gel-Derived Pseudobrookite-Type Sm0.5Sr0.5Fe2O5

    Abdullah Saad Alsubaie, Ghada Raddaoui, Karim Souifi +2

    MaqolaCrystal Structures and PropertiesBrazilian Journal of Physics20250 iqtibos
    ABI

  11. Exploring the Multifunctionality of Nd0.5Ba0.5FeO3: A computational study on structural, electronic, magnetic, and optical properties

    Karim Souifi, Ghada Raddaoui, M. Nasri +6

    MaqolaMagnetic and transport properties of perovskites and related materialsSolid State Communications20250 iqtibos
    ABI

  12. The effect of non-stoichiometry in Sb2Se3 films on their phonon and electronic properties in the infrared range

    B. Andriyevsky, Leszek Bychto, A. Patryn +14

    MaqolaChalcogenide Semiconductor Thin FilmsScientific Reports20250 iqtibos
    ABI

  13. Bioactive Chitosan/β-Tricalcium Phosphate Coatings on Titanium: Experimental Optimization and DFT Insight

    Rakiya Yu. Milusheva, И. Н. Нургалиев, Akmal Abilkasimov +1

    MaqolaBone Tissue Engineering MaterialsEurasian Journal of Chemistry20250 iqtibos
    ABI

  14. A General Selenium-Anchoring Strategy for the Synthesis of Subnanometer Metal Cluster Catalysts

    Weiming Chen, Jing Xia, Zhiyi Sun +7

    MaqolaAsymmetric Hydrogenation and CatalysisACS Catalysis20250 iqtibos
    ABI

  15. Selenium-Based Hetero-Circulene Monolayer: Coexistence of Massless Dirac Fermions, Heavy Fermions and Semiconductivity in a Single Quantum Platform with Lithium-Ion Battery Applications

    Naga Venkateswara Rao Nulakani, Yarjan Abdul Samad, Ameen Shahid +2

    PreprintGraphene research and applicationsSSRN Electronic Journal20250 iqtibos
    ABI

  16. Waste to Catalyst: Tuning Structure and Composition of Ferrous Scrap‐Derived Alloys by Rapid Solidification for Advanced Catalysis

    Yonghui Wang, Yifan Cui, Bing Li +10

    MaqolaAdvanced oxidation water treatmentAdvanced Materials20260 iqtibos
    ABI

  17. Investigation of CO2, NO2, SO2, and H2O Gas Adsorption on Al2O3, TiO2, and SiO2 Surfaces

    Davron Sh. Kurbanov, Komiljon Yakubov, Vinoth Kumar Kazi +4

    MaqolaGas Sensing Nanomaterials and SensorsChemosensors20260 iqtibos
    ABI