Mechanistic Insights into Catalytic Reduction of N2O by CO over Cu-Embedded Graphene: A Density Functional Theory Perspective

Electro-catalytic amplified sensor for determination of N-acetylcysteine in the presence of theophylline confirmed by experimental coupled theoretical investigation

(2021) Mohsen Keyvanfard et al.   Scientific Reports

A novel QCM immunosensor development based on gold nanoparticles functionalized sulfur-doped graphene quantum dot and h-ZnS-CdS NC for Interleukin-6 detection

(2021) Necip Atar et al.   ANALYTICA CHIMICA ACTA

Orange Peel Derived‐Nitrogen and Sulfur Co‐doped Carbon Dots: a Nano‐booster for Enhancing ORR Electrocatalytic Performance of 3D Graphene Networks

(2021) Ceren Karaman   ELECTROANALYSIS

Novel 1-butyl-3-methylimidazolium bromide impregnated chitosan hydrogel beads nanostructure as an efficient nanobio-adsorbent for cationic dye removal: Kinetic study

(2021) Hassan Karimi-Maleh et al.   ENVIRONMENTAL RESEARCH

Enhanced electrochemical performance and stability of Pt/Ni electrocatalyst supported on SiO2-PANI nanocomposite: A combined experimental and theoretical study

(2021) Mohammad Soleimani Lashkenari et al.   MATERIALS CHEMISTRY AND PHYSICS

A novel detection method for organophosphorus insecticide fenamiphos: Molecularly imprinted electrochemical sensor based on core-shell Co3O4@MOF-74 nanocomposite

(2021) Hassan Karimi-Maleh et al.   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Selective catalytic reduction of NO by methane over Co,H-SSZ-13 catalysts: Types and catalytic functions of active Co sites

(2020) Rania Charrad et al.   JOURNAL OF CATALYSIS

Facile synthesis of paper based graphene electrodes for point of care devices: A double stranded DNA (dsDNA) biosensor

(2020) J. Mohanraj et al.   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Direct oxidation of methane to methanol on Co embedded N-doped graphene: Comparing the role of N2O and O2 as oxidants

(2020) Parisa Nematollahi et al.   APPLIED CATALYSIS A-GENERAL

Preparation of high surface area nitrogen doped graphene for the assessment of morphologic properties and nitrogen content impacts on supercapacitors

(2020) Ceren Karaman et al.   JOURNAL OF ELECTROANALYTICAL CHEMISTRY

DFT Study on Mechanisms of the N2O Direct Catalytic Decomposition over Cu-ZSM-5: The Detailed Investigation on NO Formation Mechanism

(2020) Congru Gao et al.   Catalysts

Syngas conversion catalyzed by copper-embedded graphene

(2020) Haojie Cao et al.   APPLIED SURFACE SCIENCE

Computational investigation of N2O adsorption and dissociation on the silicon-embedded graphene catalyst: A density functional theory perspective

(2020) Mohammadtaghi Vakili et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Recent advances in removal techniques of Cr(VI) toxic ion from aqueous solution: A comprehensive review

(2020) Hassan Karimi-Maleh et al.   JOURNAL OF MOLECULAR LIQUIDS

Graphitic carbon nitride-supported cobalt oxides as a potential catalyst for decomposition of N2O

(2020) Xiaobo Hu et al.   APPLIED SURFACE SCIENCE

Transition Metal‐dinitrogen Complex Embedded Graphene for Nitrogen Reduction Reaction

(2019) Yulu Yang et al.   ChemCatChem

A new epirubicin biosensor based on amplifying DNA interactions with polypyrrole and nitrogen-doped reduced graphene: Experimental and docking theoretical investigations

(2019) Arash Khodadadi et al.   SENSORS AND ACTUATORS B-CHEMICAL

The role of magnetite/graphene oxide nano-composite as a high-efficiency adsorbent for removal of phenazopyridine residues from water samples, an experimental/theoretical investigation

(2019) Hassan Karimi-Maleh et al.   JOURNAL OF MOLECULAR LIQUIDS

DFT Study of N2O Adsorption onto the Surface of M-Decorated Graphene Oxide (M = Mg, Cu or Ag)

(2019) Zhong Liu et al.   Materials

Simultaneous determination of cholesterol, ascorbic acid and uric acid as three essential biological compounds at a carbon paste electrode modified with copper oxide decorated reduced graphene oxide nanocomposite and ionic liquid

(2019) Hassan Karimi-Maleh et al.   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Structure-sensitivity of alumina supported palladium catalysts for N2O decomposition

(2019) Nia Richards et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Advanced capabilities for materials modelling with Quantum ESPRESSO

(2017) P Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

A Highly Efficient Nanomaterial with Molecular Imprinting Polymer: Carbon Nitride Nanotubes Decorated with Graphene Quantum Dots for Sensitive Electrochemical Determination of Chlorpyrifos

(2017) Mehmet Lütfi Yola et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

N 2 O decomposition over ceria-promoted Ir/Al 2 O 3 catalysts: The role of ceria

(2016) E. Pachatouridou et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Hydrogenation of CO 2 to formic acid over a Cu-embedded graphene: A DFT study

(2016) J. Sirijaraensre et al.   APPLIED SURFACE SCIENCE

Correlation among preparation methods/conditions, physicochemical properties, and catalytic performance of Rh/hydroxyapatite catalysts in N 2 O decomposition

(2016) Chengyun Huang et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Al-doped graphene as a new nanostructure adsorbent for some halomethane compounds: DFT calculations

(2016) Ali Shokuhi Rad   SURFACE SCIENCE

Electronic properties and reactivity trend for defect functionalization of single-walled carbon nanotube with B, Al, Ga atoms

(2016) Elham Rahmanifar et al.   SYNTHETIC METALS

Adsorption of SO 2 and NO 2 on metal-doped boron nitride nanotubes: A computational study

(2016) Abdullah Al-Sunaidi   Computational and Theoretical Chemistry

Abatement of nitrous oxide by ruthenium catalysts: Influence of the support

(2015) Jian Zheng et al.   APPLIED CATALYSIS A-GENERAL

A computational study of Na behavior on graphene

(2015) Oleksandr I. Malyi et al.   APPLIED SURFACE SCIENCE

CoFe2O4@TiO2 decorated reduced graphene oxide nanocomposite for photocatalytic degradation of chlorpyrifos

(2015) Vinod Kumar Gupta et al.   JOURNAL OF MOLECULAR LIQUIDS

Sn-embedded graphene: An active catalyst for CO oxidation to CO 2 ?

(2015) Mehdi D. Esrafili et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

A sensitive molecular imprinted electrochemical sensor based on gold nanoparticles decorated graphene oxide: Application to selective determination of tyrosine in milk

(2015) Mehmet Lütfi Yola et al.   SENSORS AND ACTUATORS B-CHEMICAL

A novel and sensitive electrochemical DNA biosensor based on Fe@Au nanoparticles decorated graphene oxide

(2014) Mehmet Lütfi Yola et al.   ELECTROCHIMICA ACTA

CO oxidation catalyzed by Pt-embedded graphene: a first-principles investigation

(2014) Xin Liu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

DFT-based reactivity study of (5,5) armchair boron nitride nanotube (BNNT)

(2013) Soumen Saha et al.   CHEMICAL PHYSICS LETTERS

N2O catalytic decomposition – From laboratory experiment to industry reactor

(2012) L. Obalová et al.   CATALYSIS TODAY

Reaction Mechanisms for CO Catalytic Oxidation by N2O on Fe-Embedded Graphene

(2012) Sippakorn Wannakao et al.   Journal of Physical Chemistry C

Avogadro: an advanced semantic chemical editor, visualization, and analysis platform

(2012) Marcus D Hanwell et al.   Journal of Cheminformatics

CO Catalytic Oxidation on Copper-Embedded Graphene

(2011) E. H. Song et al.   Journal of Physical Chemistry C

Adsorption of gas molecules on transition metal embedded graphene: a search for high-performance graphene-based catalysts and gas sensors

(2011) Miao Zhou et al.   NANOTECHNOLOGY

Mullite-supported Rh catalyst: a promising catalyst for the decomposition of N2O propellant

(2010) Xiangyun Zhao et al.   CHEMICAL COMMUNICATIONS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

CO Catalytic Oxidation on Iron-Embedded Graphene: Computational Quest for Low-Cost Nanocatalysts

(2010) Yafei Li et al.   Journal of Physical Chemistry C

First-principles study of substitutional metal impurities in graphene: structural, electronic and magnetic properties

(2010) E J G Santos et al.   NEW JOURNAL OF PHYSICS

Metal-Embedded Graphene: A Possible Catalyst with High Activity

(2009) Yun-Hao Lu et al.   Journal of Physical Chemistry C

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Embedding Transition-Metal Atoms in Graphene: Structure, Bonding, and Magnetism

(2009) A. V. Krasheninnikov et al.   PHYSICAL REVIEW LETTERS

VESTA: a three-dimensional visualization system for electronic and structural analysis

(2008) Koichi Momma et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY