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85 ta ish

Ish: Density functional theory investigation of pure and doped boron nitride nanoclusters for ultrasensitive detection of colorectal cancer biomarkers in exhaled breath

  1. General atomic and molecular electronic structure system

    Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz +10

    Maqola199349 iqtibos
    ABI

  2. Defect-engineered rGO−CoNi2S4 with enhanced electrochemical performance for asymmetric supercapacitor

    Xu Wang, Bowang Zhao, Jia-yu LIANG +5

    Maqola202528 iqtibos
    ABI

  3. Balancing Intermediates Formation on Atomically Pd‐Bridged Cu/Cu <sub>2</sub> O Interfaces for Kinetics‐Matching Electrocatalytic C─N Coupling Reaction

    Yan Wang, Shuai Xia, Kui Chen +6

    Maqola202524 iqtibos
    ABI

  4. Rationally Constructed <i>De Novo</i> Fluorescent Nanosensor for Nitric Oxide Detection and Imaging in Living Cells and Inflammatory Mice Models

    Qiaomei Yang, Yizhuang Zhou, Libin Tan +5

    Maqola202318 iqtibos
    ABI

  5. A novel porous egg-white (EW)/titania composite photocatalytic material for efficient photodegradation applications

    Guo Feng, Feng Jiang, Zi Hu +7

    Maqola202017 iqtibos
    ABI

  6. Adsorption mechanism of hydrated Lu(OH)2+ and Al(OH)2+ ions on the surface of kaolinite

    Huashan Yan, Bin Yang, Xiaowen Zhou +9

    Maqola202215 iqtibos
    ABI

  7. Low Temperature Preparation of Aluminum Titanate Film via Sol-Gel Method

    Yi Wang Bao, Wei Jiang, Guo Feng +2

    Maqola201415 iqtibos
    ABI

  8. A novel green nonaqueous sol-gel process for preparation of partially stabilized zirconia nanopowder

    Guo Feng, Weihui Jiang, Jianmin Liu +3

    Maqola201714 iqtibos
    ABI

  9. Theoretical investigation of hydrated [Lu(OH)2]+ adsorption on kaolinite(0 0 1) surface with DFT calculations

    Sen Qiu, Hao Wu, Huashan Yan +3

    Maqola202113 iqtibos
    ABI

  10. Influence mechanism of leaching agent anions on the leaching of aluminium impurities in ionic-type rare earth ores: A DFT simulation combined with experimental verification

    Qibang Long, Huashan Yan, Hao Wu +3

    Maqola202411 iqtibos
    ABI

  11. Nanoscale covalent organic frameworks: from controlled synthesis to cancer therapy

    Xuelu He, Zhenqi Jiang, Ozioma Udochukwu Akakuru +2

    Sharh maqola20219 iqtibos
    ABI

  12. Multiple defects renovation and phase reconstruction of reduced-dimensional perovskites via in situ chlorination for efficient deep-blue (454 nm) light-emitting diodes

    Mubing Yu, Ting‐Xiao Qin, Gang Gao +8

    Maqola20258 iqtibos
    ABI

  13. Sensing of carbamazepine by AlN and BN nanoclusters in gas and solvent phases: DFT and TD-DFT calculation

    Mir Saleh Hoseininezhad-Namin, Elaheh Rahimpour, Síbel A. Özkan +2

    Maqola20227 iqtibos
    ABI

  14. A first-principles study of SOF2 and SO2F2 adsorption onto PdSe2-based monolayers: Favorable sensitivity and selectivity by doping single Cu or Rh atom

    Hao Cui, Jian Hu, Xiaoping Jiang +1

    Maqola20257 iqtibos
    ABI

  15. Carbon Nanotube Sensors for Gas and Organic Vapor Detection

    Jing Li, Yijiang Lu, Ye Qi +3

    Maqola20036 iqtibos
    ABI

  16. Effects of B and N doping/codoping on the adsorption behavior of C60 fullerene towards aspirin: A DFT investigation

    Fateme Nattagh, Sharieh Hosseini, Mehdi D. Esrafili

    Maqola20216 iqtibos
    ABI

  17. Noble metal (Pd, Pt)-functionalized WSe2 monolayer for adsorbing and sensing thermal runaway gases in LIBs: A first-principles investigation

    Hao Cui, Hailong Wu, Dan He +1

    Maqola20256 iqtibos
    ABI

  18. Rational construction of a fluorescent sensor for simultaneous detection and imaging of hypochlorous acid and peroxynitrite in living cells, tissues and inflammatory rat models

    Yizhuang Zhou, Jiaqi Zeng, Qiaomei Yang +1

    Maqola20225 iqtibos
    ABI

  19. Theoretical study of adsorption of amino acids on graphene and BN sheet in gas and aqueous phase with empirical DFT dispersion correction

    Preeti Singla, Mohd Riyaz, Sonal Singhal +1

    Maqola20165 iqtibos
    ABI

  20. Boron nitride nanocluster as a carrier for lomustine anticancer drug delivery: DFT and thermodynamics studies

    Elnaz Golipour-Chobar, Farshid Salimi, Gholamreza Ebrahimzadeh Rajaei

    Maqola20204 iqtibos
    ABI

  21. Ab initio study of solvated molecules: a new implementation of the polarizable continuum model

    Maurizio Cossi, Vincenzo Barone, Roberto Cammi +1

    Maqola19964 iqtibos
    ABI

  22. A smart mitochondria-targeting TP-NIR fluorescent probe for the selective and sensitive sensing of H<sub>2</sub>S in living cells and mice

    Qiaomei Yang, Liyi Zhou, Longpeng Peng +4

    Maqola20214 iqtibos
    ABI

  23. Low Temperature Synthesis of Ultrafine Al&lt;sub&gt;2&lt;/sub&gt;TiO&lt;sub&gt;5&lt;/sub&gt; Powders by Hydrolytic Sol-Gel Method

    Quan Zhang, Wei Jiang, Jian Min Liu +2

    Maqola20163 iqtibos
    ABI

  24. Au-decorated BN nanotube as a breathalyzer for potential medical applications

    Chenjiao Ge, Mingli Li, Mingxuan Li +1

    Maqola20203 iqtibos
    ABI

  25. A computational study on the SO2 adsorption by the pristine, Al, and Si doped BN nanosheets

    Farnaz Behmagham, Esmail Vessally, Bakhshali Massoumi +2

    Maqola20163 iqtibos
    ABI