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[1]
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Hybrid MXene-Graphene/Hexagonal Boron Nitride Structures: Electronic and Molecular Adsorption Properties
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Nanomaterials,
2022 |
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[2]
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Theoretical analysis of the uptake of CO, CO2, and NO2 on pristine and BN-doped carbon nanocones
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Hernández, A Flores-López… - Chemical Physics …,
2022 |
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[3]
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Selective adsorption and dissociation of NO, NO2, and N2O molecules on Si-doped haeckelite boron nitride nanotube: an investigation for sensitive molecular …
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Journal of Molecular …,
2022 |
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[4]
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Adsorption behavior of diatomic gases with defected hexagonal boron nitride nanosheet: A DFT study
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Materials Today Communications,
2022 |
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[5]
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Estudo ab initio de nanotubos, com ênfase na adsorção e encapsulamento de átomos e moléculas
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2021 |
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[6]
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DFT study of Se-doped nanocones as highly efficient hydrogen storage carrier
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Barbary, MA Alkhateeb - Graphene,
2021 |
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[7]
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The first principle study of magnetic, electronic, and optical properties of Co-and Mn-doped boron nitride nanosheets
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2021 |
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[8]
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Potential application of BC3 nanotubes as a gamma-hydroxybutyric acid drug sensor: A DFT study
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2021 |
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[9]
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Graphene: An Insight Into Electrochemical Sensing Technology
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2020 |
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[10]
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A selective NO sensor based on the semiconducting BC2N nanotubes: a computational study
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2020 |
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[11]
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A computational study on the potential application of yne-BN monolayer for selective detection of NO and CO gases
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2020 |
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[12]
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Theoretical insights into the adsorption behavior of CO molecules on the pure and Vn-doped BN nanotubes
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2020 |
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[13]
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Effect of platinum on the sensing performance of ZnO nanocluster to CO gas
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2020 |
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[14]
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Hydrogen Adsorption Mechanism of SiC Nanocones
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2020 |
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[15]
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Adsorption of NO2, HCN, HCHO and CO on pristine and amine functionalized boron nitride nanotubes by self-consistent charge density functional tight-binding …
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2020 |
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[16]
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Graphitic carbon nitride as a fascinating adsorbent for toxic gases: A mini-review
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2020 |
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[17]
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Graphyne-like BN sheet as a selective gas sensor for NO2 gas: A quantum mechanical analysis
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2020 |
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[18]
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Gamma-butyrolactone drug detection by Al-doped BC3 nanotubes: A density functional theory study
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2020 |
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[19]
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A first-principle investigation of NO2 adsorption behavior on Co, Rh, and Ir-embedded graphitic carbon nitride: Looking for highly sensitive gas sensor
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2019 |
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[20]
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First-principles study on the adsorption of hydrogen cyanide on the Metal-doped (8, 0) Boron Nitride Nanotubes
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2019 |
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[21]
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A DFT study for adsorption of CO on Ni, Pd and Pt atoms doped (7, 0) boron nitride nanotube
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Disability and Rehabilitation,
2018 |
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[22]
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Adsorption of cyanogen chloride on the surface of boron nitride nanotubes for CNCl sensing
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Chemical Physics Letters,
2018 |
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[23]
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Adsorption of HCN molecules on Ni, Pd and Pt-doped (7, 0) boron nitride nanotube: a DFT study
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Molecular Physics,
2018 |
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[24]
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Simulation and Calculation of BN Nano-Sensor for Exit Gas of Open Burning Waste: DFT Method
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Artificial Cells Nanomedicine and Biotechnology,
2017 |
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[25]
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Sensitivity of Perfect and Stone-Wales Defective BNNTs Toward NO Molecule: A DFT/M06-2X Approach
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2017 |
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[26]
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Adsorption of SO 2 and NO 2 on metal-doped boron nitride nanotubes: A computational study
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Computational and Theoretical Chemistry,
2016 |
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[27]
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DFT study of carbon monoxide adsorption on zinc oxide nanocone
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2016 |
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[28]
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Adsorption of SO2 and NO2 on metal-doped boron nitride nanotubes: A computational study
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Computational and Theoretical Chemistry,
2016 |
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[29]
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A DFT study on comparison of Terpyrrole, Terthiophene, and Dianiline in adsorption of nitrous oxide
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Iranian Journal of Organic Chemistry,
2015 |
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