Publications

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Fields of Research (FoR 2020):  340701 Computational chemistry
Author:  Hussain, T

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Publication DateTitleAuthor(s)Date Added
11-Aug-2021Empowering hydrogen storage properties of haeckelite monolayers via metal atom functionalizationLiu, Zhiyang; Hussain, Tanveer ; Karton, Amir ; Er, Süleyman2-Mar-2022
230-Jan-2021Scavenging properties of yttrium nitride monolayer towards toxic sulfur gasesNgoipala, Apinya; Kaewmaraya, Thanayut; Hussain, Tanveer ; Karton, Amir 4-Mar-2022
35-Jan-2021Novel green phosphorene as a superior chemical gas sensing materialKaewmaraya, T; Ngamwongwan, L; Moontragoon, P; Jarernboon, W; Singh, D; Ahuja, R; Karton, Amir ; Hussain, T 3-Mar-2022
4Dec-2020Improved Adsorption and Migration of Divalent Ions Over C4N Nanosheets: Potential Anode for Divalent BatteriesPanigrahi, Puspamitra; Alhameedi, Khidhir; Karton, Amir ; Ahuja, Rajeev; Hussain, Tanveer 9-Mar-2022
515-Aug-2020The adsorption and migration behavior of divalent metals (Mg, Ca, and Zn) on pristine and defective grapheneOlsson, Emilia; Hussain, Tanveer ; Karton, Amir ; Cai, Qiong7-Mar-2022
615-Aug-2020Sensing of volatile organic compounds on two-dimensional nitrogenated holey graphene, graphdiyne, and their heterostructureHussain, Tanveer ; Sajjad, Muhammad; Singh, Deobrat; Bae, Hyeonhu; Lee, Hoonkyung; Larsson, J. Andreas; Ahuja, Rajeev; Karton, Amir 11-Mar-2022
77-May-2020Functionalized Two-Dimensional Nanoporous Graphene as Efficient Global Anode Materials for Li-, Na-, K-, Mg-, and Ca-Ion BatteriesHussain, Tanveer ; Olsson, Emilia; Alhameedi, Khidhir; Cai, Qiong; Karton, Amir 11-Mar-2022
824-Jan-2020Remarkable improvement in hydrogen storage capacities of two-dimensional carbon nitride (g-C3N4) nanosheets under selected transition metal dopingPanigrahi, Puspamitra; Kumar, Ashok; Karton, Amir ; Ahuja, Rajeev; Hussain, Tanveer 11-Mar-2022
930-Nov-2019Sensitivity enhancement of stanene towards toxic SO2 and H2SVovusha, Hakkim; Hussain, Tanveer ; Sajjad, Muhammad; Lee, Hoonkyung; Karton, Amir ; Ahuja, Rajeev; Schwingenschlogl, Udo23-Mar-2022
10Nov-2019Reversible hydrogen storage properties of defect-engineered C4N nanosheets under ambient conditionsAlhameedi, Khidhir; Hussain, Tanveer ; Bae, Hyeonhu; Jayatilaka, Dylan; Lee, Hoonkyung; Karton, Amir 23-Mar-2022
1125-Oct-2019Elemental Substitution of Two-Dimensional Transition Metal Dichalcogenides (MoSe2 and MoTe2): Implications for Enhanced Gas SensingPanigrahi, Puspamitra; Hussain, Tanveer ; Karton, Amir ; Ahuja, Rajeev23-Mar-2022
1230-Aug-2019Blue phosphorene monolayers as potential nano sensors for volatile organic compounds under point defectsSun, Suyang; Hussain, Tanveer ; Zhang, Wei; Karton, Amir 21-Mar-2022
13Jun-2019Enhancement in hydrogen storage capacities of light metal functionalized Boron-Graphdiyne nanosheetsHussain, Tanveer ; Mortazavi, Bohayra; Bae, Hyeonhu; Rabczuk, Timon; Lee, Hoonkyung; Karton, Amir 23-Mar-2022
1431-Mar-2019Metal functionalized inorganic nano-sheets as promising materials for clean energy storageAlhameedi, Khidhir; Karton, Amir ; Jayatilaka, Dylan; Hussain, Tanveer 23-Mar-2022
151-Mar-2019Efficient and selective sensing of nitrogen-containing gases by Si2BN nanosheets under pristine and pre-oxidized conditionsHussain, T ; Singh, D; Gupta, Sanjeev K; Karton, A ; Sonvane, Yogesh; Ahuja, R23-Mar-2022
1615-Feb-2019Tailoring the capability of carbon nitride (C3N) nanosheets toward hydrogen storage upon light transition metal decorationFaye, Omar; Hussain, Tanveer ; Karton, Amir ; Szpunar, Jerzy23-Mar-2022
1712-Oct-2018Graphitic carbon nitride nano sheets functionalized with selected transition metal dopants: an efficient way to store CO2Hussain, T ; Vovusha, H; Kaewmaraya, T; Karton, A ; Amornkitbamrung, V; Ahuja, R23-Mar-2022
186-Sep-2018Drastic Improvement in Gas-Sensing Characteristics of Phosphorene Nanosheets under Vacancy Defects and Elemental FunctionalizationKaewmaraya, T; Ngamwongwan, L; Moontragoon, P; Karton, A ; Hussain, T 20-Mar-2022

Credit Name
Amir Karton
Full Name
Karton, Amir
Variants
Karton, A
 
UNE Researcher ID
une-id:akarton
 
Position Title
Professor in Physical/Materials Chemistry
 
 
 
Other emails
 
Google Scholar profile key
ogleADAAAAAJ
Scopus Author ID
Clarivate Researcher ID
 
Biography
Professor Amir Karton leads the quantum chemistry group at the School of Science and Technology at the University of New England (Web: www.chemtheorist.com; Twitter: @CompQuantumChem). The research in Prof. Karton’s group is highly interdisciplinary and lies at the interface of materials, biology, physics, and chemistry. His group develops quantum chemical theories to calculate highly accurate chemical properties and then applies these theories to problems of chemical structure, mechanism, and design. Prof. Karton’s applied studies range from nanochemistry to biochemistry. Including the computational design of super-thin, 2D functional materials for energy storage, molecular separation, and green catalysis applications, the computational design of small bioactive molecules, and highly accurate simulations of atmospheric and astrochemical reactions. His research group employs a range of computational techniques including machine-learning force fields, density functional theory, and ab initio quantum chemical methods. At UNE, Prof. Karton's research is focused on developing nanotechnology solutions for energy conversion and storage. This research is well-aligned with the United Nations Sustainable Development Goal of affordable and clean energy, ensuring access to energy for all. Prof. Karton’s research has been recognized by the Royal Australian Chemical Institute (RACI) Citation Award (2021), American Chemical Society (ACS) PHYS Division Lectureship Award (2020), RACI Physical Chemistry Lectureship (2019), and Le Fèvre Medal from the Australian Academy of Science (2018).
 
Discipline
School of S&T - Chemistry
 
Faculty
Faculty of Science, Ag, Business and Law
Surname
Karton
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Given Name
Amir
 
School/Department
School of Science and Technology
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