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Published in 2020 at "Advanced Functional Materials"
DOI: 10.1002/adfm.202005016
Abstract: Graphene, carbon nanotubes (CNTs) and fullerenes are the basic set of low‐dimensional carbon allotropes. The latter two arise from the former by selective removal and addition of carbon atoms. Nevertheless, given their morphological disparities, the…
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Keywords:
low dimensional;
carbon;
carbon allotropes;
graphene ... See more keywords
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Published in 2018 at "Carbon"
DOI: 10.1016/j.carbon.2018.07.038
Abstract: We have investigated through fully atomistic reactive molecular dynamics and DFT simulations, the mechanical properties and fracture dynamics of novamene, a new 3D carbon allotrope structure recently proposed. Our results showed that novamene is an…
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Keywords:
dynamics dft;
molecular dynamics;
mechanical properties;
fully atomistic ... See more keywords
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Published in 2022 at "Chemosphere"
DOI: 10.1016/j.chemosphere.2022.133731
Abstract: Nanotechnology for the past decade has made tremendous improvement and diverse applications in various sector. Among the nanomaterials synthesized, carbon allotropes are advantageous due to its easy functionalization, conductivity, surface area and electrical activity. Hence,…
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Keywords:
carbon nanomaterials;
carbon;
carbon allotropes;
pharmaceuticals brief ... See more keywords
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Published in 2020 at "Computational Materials Science"
DOI: 10.1016/j.commatsci.2020.109634
Abstract: Abstract In this manuscript, is addressed the computational prediction of five new allotropes based on the Squaroglitter structure (tP8 carbon). DFT calculations of tP12, tP16, tP24, oP12 and oP18 allotropes attest their nanotube and cage…
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Keywords:
allotropes squaroglitter;
squaroglitter structures;
carbon;
five carbon ... See more keywords
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Published in 2019 at "Chemical Physics Letters"
DOI: 10.1016/j.cplett.2019.03.012
Abstract: Abstract Nanocomposites of TiO2 and carbon allotropes oxides (single and multi-walled nanotubes and graphene) have been prepared and characterized via scanning electron microscopy, thermogravimetric analysis and resonance Raman spectroscopy. The chemical interaction between TiO2 and…
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Keywords:
allotropes oxides;
chemical interaction;
spectroscopy;
interaction ... See more keywords
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Published in 2019 at "Journal of colloid and interface science"
DOI: 10.1016/j.jcis.2019.01.087
Abstract: Recently, hierarchical porous materials have received tremendous attention in electrochemical supercapacitors and CO2 adsorption. Both areas of application have a positive impact on global warming by reducing CO2 emissions to the atmosphere. Herein, we synthesized…
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Keywords:
adsorption;
hybrid ceramics;
carbon;
material supercapacitor ... See more keywords
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Published in 2021 at "ACS nano"
DOI: 10.1021/acsnano.1c03536
Abstract: Flash Joule heating (FJH), an advanced material synthesis technique, has been used for the production of high-quality carbon materials. Direct current discharge through the precursors by large capacitors has successfully converted carbon-based starting materials into…
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Keywords:
carbon;
phase evolution;
flash joule;
joule heating ... See more keywords
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Published in 2019 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.9b08060
Abstract: Various two-dimensional (2D) carbon allotropes with non-alternant topologies, such as pentaheptites and phagraphene, have been proposed. Predictions indicate that these metastable carbon polymorphs, which contain odd-numbered rings, possess unusual (opto)electronic properties. However, none of these…
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Keywords:
carbon;
topology;
nanoribbons non;
carbon allotropes ... See more keywords
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Published in 2018 at "NPG Asia Materials"
DOI: 10.1038/s41427-018-0017-6
Abstract: Self-assembled synthetic hybrid materials are an important class of artificial materials with potential applications in various fields ranging from optoelectronics to medicine. The noncovalent interactions involved in the self-assembly process offer a facile way to…
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Keywords:
hybrid materials;
allotropes synthetic;
self assembled;
synthetic systems ... See more keywords
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Published in 2019 at "Nanoscale"
DOI: 10.1039/c9nr08069d
Abstract: Graphene and carbon nanotubes (CNT) are the representatives of two-dimensional (2D) and one-dimensional (1D) forms of carbon, both exhibiting unique geometric structures and peculiar physical and chemical properties. Herein, we propose a family or series…
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Keywords:
highly anisotropic;
carbon;
nano makisu;
two dimensional ... See more keywords
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Published in 2020 at "Journal of Materials Chemistry C"
DOI: 10.1039/c9tc05470g
Abstract: We report on a family of all-sp2 carbon allotropes constructed by interconnected screw dislocations with complementary chiralities through atomistic calculations. The carbon allotropes have lattice periodicities defined by the interspacing among screw dislocations and are…
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Keywords:
carbon;
topological semimetals;
nodal lines;
family sp2 ... See more keywords