2017 January 22
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Yesterday : 28
Month : 99
Current year : 4210
 
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An article titled “Oxidized Armchair Graphene act as a VARISTOR nano-electronic device: DFT- NEGF computationms"accepted in Journal of Molecular Physics.
2015 Monday 18 May

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An article titled "Improving the adsorption of sulphur trioxide on TiO2 anatase nanoparticles by N-doping: A DFT study” was accepted for publication in journal of theoretical and computational chemistry"
2015 Monday 20 Apr

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An article titled “ The Quantum Transport of Pyrene and its Silicon-Dopped Variant: A DFT-NEGF Approach” was accepted for publication in Journal of computational electronics ((J Comput Electron))
2015 Tuesday 14 Apr

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An article titled "Multi Switching Behavior of Hydrogen Passivated Silicene as Molecular Junction: A DFT-NEGF Approach” was published in journal of theoretical and computational chemistry"
2015 Thursday 09 Apr

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An article titled "The adsorption of sulfur dioxide on TiO2 anatase nanoparticles: A density functional theory study” was accepted for publication in "Canadian Journal of Chemistry, NRC research press"
2015 Wednesday 08 Apr

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An article titled “Molecular Interactions in the Systems Composed of Curcumin, Water and Single-Walled Carbon Nanotube: A Molecular Dynamics Simulation Study” was published in journal of Computational and Theoretical Nanoscience
2015 Thursday 22 Jan

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An article titled “ Ab Initio Study of Structure Pyridinium-Based Ionic Liquids and Derivatives ” was published in Quantum Matter
2015 Thursday 22 Jan

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An article titled “ A First Principles Study of Interaction of Water with Boron–Nitrogen Doped Adamantane Nano Block ” was published in journal of Computational and Theoretical Nanoscience
2015 Thursday 22 Jan

An article titled “ Water desalination through armchair carbon nanotubes” was published in RSC-Advances journal of Royal Society of Chemistry

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2014 Tuesday 09 Dec