Auswahl der wissenschaftlichen Literatur zum Thema „Silicène“

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Zeitschriftenartikel zum Thema "Silicène"

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Denis, Pablo A. "Stacked functionalized silicene: a powerful system to adjust the electronic structure of silicene." Physical Chemistry Chemical Physics 17, no. 7 (2015): 5393–402. http://dx.doi.org/10.1039/c4cp05331a.

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Shrestha, Prajwal, and Nurapathi Panth. "Adsorption of Hydrogen Molecules in Nickel Decorated Silicene." Himalayan Journal of Science and Technology 7, no. 1 (2023): 18–25. http://dx.doi.org/10.3126/hijost.v7i1.61165.

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First-principles simulations based on density functional theory (DFT) have been used to study the structural, electronic and magnetic properties of pristine and Ni decorated silicene sheets. Generalized Gradient Approximation (GGA) based exchange correlation functionals are used under software package Quantum ESPRESSO (QE), 6.5 versions. We have reconstructed the optimized unit cell of silicene, which has a face centered cubic (fcc) structure with two silicon atoms having lattice parameters a = b = 3.8 Å. The distance between two nearest silicene monolayers is found to be 20.5 Å which is large
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Galashev, Alexander, and Alexey Vorob'ev. "An Ab Initio Study of Lithization of Two-Dimensional Silicon–Carbon Anode Material for Lithium-Ion Batteries." Materials 14, no. 21 (2021): 6649. http://dx.doi.org/10.3390/ma14216649.

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This work is devoted to a first-principles study of changes in the structural, energetic, and electronic properties of silicene anodes during their lithium filling. Anodes were presented by silicene on carbon substrate and free-standing silicene. The ratio of the amount of lithium to silicon varied in the range from 0.06 to 1.125 for silicene on bilayer graphene and from 0.06 to 2.375 for free-standing silicene. It is shown that the carbon substrate reduces the stability of the silicene sheet. Silicene begins to degrade when the ratio of lithium to silicon (NLi/NSi) exceeds ~0.87, and at NLi/N
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Wella, Sasfan Arman, Irfan Dwi Aditya, Triati Dewi Kencana Wungu, and Suprijadi. "Density Functional Theory (DFT) Study: Electronic Properties of Silicene under Uniaxial Strain as H2S Gas Sensor." Key Engineering Materials 675-676 (January 2016): 15–18. http://dx.doi.org/10.4028/www.scientific.net/kem.675-676.15.

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First principle calculation is performed to investigate structural and electronic properties of strained silicene (silicon analogue of graphene) when absorbing the hydrogen sulfide molecule gas. Two configuration of silicene-H2S system, center and hollow configuration, is checked under 0% (pure), 5%, and 10% uniaxial engineering strain. We report that the silicene-H2S system in center configuration has larger binding energy compare to the silicene-H2S system in hollow configuration. The results show that H2S is physisorbed on silicene. In this work, we also find the change of band gap energy (
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Du, Yi, Jincheng Zhuang, Jiaou Wang, et al. "Quasi-freestanding epitaxial silicene on Ag(111) by oxygen intercalation." Science Advances 2, no. 7 (2016): e1600067. http://dx.doi.org/10.1126/sciadv.1600067.

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Silicene is a monolayer allotrope of silicon atoms arranged in a honeycomb structure with massless Dirac fermion characteristics similar to graphene. It merits development of silicon-based multifunctional nanoelectronic and spintronic devices operated at room temperature because of strong spin-orbit coupling. Nevertheless, until now, silicene could only be epitaxially grown on conductive substrates. The strong silicene-substrate interaction may depress its superior electronic properties. We report a quasi-freestanding silicene layer that has been successfully obtained through oxidization of bi
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Feng, Ya, Defa Liu, Baojie Feng, et al. "Direct evidence of interaction-induced Dirac cones in a monolayer silicene/Ag(111) system." Proceedings of the National Academy of Sciences 113, no. 51 (2016): 14656–61. http://dx.doi.org/10.1073/pnas.1613434114.

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Silicene, analogous to graphene, is a one-atom-thick 2D crystal of silicon, which is expected to share many of the remarkable properties of graphene. The buckled honeycomb structure of silicene, along with enhanced spin-orbit coupling, endows silicene with considerable advantages over graphene in that the spin-split states in silicene are tunable with external fields. Although the low-energy Dirac cone states lie at the heart of all novel quantum phenomena in a pristine sheet of silicene, a hotly debated question is whether these key states can survive when silicene is grown or supported on a
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Chuan, Mu Wen, Kien Liong Wong, Afiq Hamzah, et al. "2D Honeycomb Silicon: A Review on Theoretical Advances for Silicene Field-Effect Transistors." Current Nanoscience 16, no. 4 (2020): 595–607. http://dx.doi.org/10.2174/1573413715666190709120019.

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Catalysed by the success of mechanical exfoliated free-standing graphene, two dimensional (2D) semiconductor materials are successively an active area of research. Silicene is a monolayer of silicon (Si) atoms with a low-buckled honeycomb lattice possessing a Dirac cone and massless fermions in the band structure. Another advantage of silicene is its compatibility with the Silicon wafer fabrication technology. To effectively apply this 2D material in the semiconductor industry, it is important to carry out theoretical studies before proceeding to the next step. In this paper, an overview of si
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Motamedi, Mohsen. "A space structural mechanics model of silicene." Proceedings of the Institution of Mechanical Engineers, Part N: Journal of Nanomaterials, Nanoengineering and Nanosystems 234, no. 1-2 (2020): 3–10. http://dx.doi.org/10.1177/2397791420905237.

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The two-dimensional nanostructures such as graphene, silicene, germanene, and stanene have attracted a lot of attention in recent years. Many studies have been done on graphene, but other two-dimensional structures have not yet been studied extensively. In this work, a molecular dynamics simulation of silicene was done and stress–strain curve of silicene was obtained. Then, the mechanical properties of silicene were investigated using the proposed structural molecular mechanics method. First, using the relations governing the force field and the Lifson–Wershel potential function and structural
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Galashev, Alexander, and Alexey Vorob’ev. "Electronic Properties and Structure of Silicene on Cu and Ni Substrates." Materials 15, no. 11 (2022): 3863. http://dx.doi.org/10.3390/ma15113863.

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Silicene, together with copper or nickel, is the main component of electrodes for solar cells, lithium-ion batteries (LIB) and new-generation supercapacitors. The aim of this work was to study the electronic properties and geometric structure of “silicene–Ni” and “silicene–Cu” systems intended for use as LIB electrodes. The densities of electronic states, band structures, adhesion energies and interatomic distances in the silicene–(Cu, Ni) systems were determined by ab initio calculations. Silicene on a copper substrate exhibited temperature stability in the temperature range from 200 to 800 K
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Rai, Suraj, Rajendra Prasad Adhikari, and Nurapati Pantha. "Adsorption of molecular methane on strained silicene." Journal of Nepal Physical Society 10, no. 2 (2024): 121–26. https://doi.org/10.3126/jnphyssoc.v10i2.79499.

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Silicene has drawn enormous research interest due to its extraordinary properties and potential applications. It adopts sp3 hybridization in honeycomb structure and forms a buckled surface. We performed first-principles calculations to study the geometrical, electronic and stability related properties of silicene under the influence of uniaxial strain. Varying uniaxial strain, 0% to 8%, was applied along the x-direction of monolayer silicene to analyze its stability and reactivity under stress. Our results show the finite band gap in strained silicene instead of zero gap Dirac cone in pristine
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Dissertationen zum Thema "Silicène"

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Ben, Jabra Zouhour. "Study of new heterostructures : silicene on graphene." Electronic Thesis or Diss., Aix-Marseille, 2021. http://www.theses.fr/2021AIXM0583.

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Le but de ce travail est la croissance du silicène sur Gr. J'ai décrit le substrat en fonction des conditions d’élaboration par CVD. Lorsque la proportion de H2 est faible il est possible d’obtenir du Gr homogène sur couche tampon (BL) sur SiC. Le STM et LEED montrent la superposition de la maille du Gr et de la reconstruction de la BL représentatif du Gr épitaxié. Lorsque la proportion de H2 est élevée la couche de Gr obtenue est totalement hydrogénée. Ceci est un résultat nouveau car aucun procédé d’intercalation d’hydrogène n’avait permis jusqu’à présent d’hydrogéner totalement les échantil
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Solonenko, Dmytro Ihorovych. "Vibrational properties of epitaxial silicene on Ag(111)." Doctoral thesis, Universitätsbibliothek Chemnitz, 2017. http://nbn-resolving.de/urn:nbn:de:bsz:ch1-qucosa-229702.

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This dissertation works out the vibrational properties of epitaxial silicene, which was discovered by Vogt et al. in 2012 by the epitaxial synthesis on the silver substrate. Its two-dimensional (2D) character is modified in comparison to the free-standing silicene due to its epitaxial nature, since the underlying substrate alters the physical properties of silicene as a result of the strong hybridization of the electronic levels of the substrate and adlayer. The growth of silicene layers is complicated by the sensitivity of the Si structures to the experimental conditions, mainly temperature,
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Solonenko, Dmytro Ihorovych. "Vibrational properties of epitaxial silicene on Ag(111)." Doctoral thesis, Universitätsverlag der Technischen Universität Chemnitz, 2016. https://monarch.qucosa.de/id/qucosa%3A20801.

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This dissertation works out the vibrational properties of epitaxial silicene, which was discovered by Vogt et al. in 2012 by the epitaxial synthesis on the silver substrate. Its two-dimensional (2D) character is modified in comparison to the free-standing silicene due to its epitaxial nature, since the underlying substrate alters the physical properties of silicene as a result of the strong hybridization of the electronic levels of the substrate and adlayer. The growth of silicene layers is complicated by the sensitivity of the Si structures to the experimental conditions, mainly temperature,
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Ji, Zhonghang. "Strain-induced Energy Band-gap Opening of Silicene." Wright State University / OhioLINK, 2015. http://rave.ohiolink.edu/etdc/view?acc_num=wright1432635166.

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Quertite, Khalid. "Silicene growth on insulating ultra-thin film of NaCl." Thesis, Université Paris-Saclay (ComUE), 2018. http://www.theses.fr/2018SACLS467.

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Le silicène est l’équivalent du graphène pour le silicium avec une structure bidimensionnelle (2D). Il est supposé avoir des propriétés électroniques intéressantes comme les fermions de Dirac sans masse et présentant une grande mobilité des électrons. L’existence du silicène a été montrée récemment sur des substrats de métaux nobles comme l’argent ou l’or. Cependant les résultats montrent des interactions fortes entre la couche de silicène et le substrat métallique, ce qui a pour conséquence de détruire les propriétés électroniques intrinsèques du silicène. Dans le but de résoudre ce problème,
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Osborn, Tim H. "Ab Initio Simulations of Hydrogen and Lithium Adsorption on Silicene." Wright State University / OhioLINK, 2010. http://rave.ohiolink.edu/etdc/view?acc_num=wright1283177822.

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Benasutti, Patrick B. "Electronic and Structural Properties of Silicene and Graphene Layered Structures." Wright State University / OhioLINK, 2012. http://rave.ohiolink.edu/etdc/view?acc_num=wright1348192958.

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Ji, Zhonghang. "Exploring Two-Dimensional Graphene and Silicene in Digital and RF Applications." Wright State University / OhioLINK, 2019. http://rave.ohiolink.edu/etdc/view?acc_num=wright1576345750912449.

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Ince, Alper. "Investigation Of The Structural Properties Of Silicene Nanoribbons By Molecular Dynamics Simulations." Master's thesis, METU, 2012. http://etd.lib.metu.edu.tr/upload/12614331/index.pdf.

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With the emergence of nanotechnology, mankind has obtained the capability to manipulate materials at nanoscale and this led to the invention of a new group of novel materials like carbon nanotubes, graphene and quantum nanodots. Silicene nanoribbons (SiNRs) are one of the newest members of this nanomaterial family which has been synthesized very recently by deposition on silver substrates. A SiNR sheet is made up of a layer of two dimensional honeycomb structure solely composed of silicon atoms. In this thesis, structural and mechanical properties of SiNR are being investigated with the help o
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Curcella, Alberto. "Looking for silicene: studies of silicon deposition on metallic and semiconductor substrates." Master's thesis, Alma Mater Studiorum - Università di Bologna, 2015. http://amslaurea.unibo.it/9314/.

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Nel presente lavoro espongo i risultati degli esperimenti svolti durante la mia internship all’Institut des NanoSciences de Paris (INSP), presso l’Università Pierre et Marie Curie (Paris VI), nel team "Phisico-Chimie et Dynamique des Surfaces", sotto la supervisione del Dott. Geoffroy Prévot. L’elaborato è stato redatto e in- tegrato sotto la guida del Dott. Pasquini, del dipartimento di Fisica e Astronomia dell’Università di Bologna. La tesi s’inserisce nel campo di ricerca del silicene, i.e. l’allotropo bidimensionale del silicio. Il cosidetto free-standing silicene è stato predetto teoricam
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Bücher zum Thema "Silicène"

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Vogt, Patrick, and Guy Le Lay, eds. Silicene. Springer International Publishing, 2018. http://dx.doi.org/10.1007/978-3-319-99964-7.

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Spencer, Michelle J. S., and Tetsuya Morishita, eds. Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9.

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Cahangirov, Seymur, Hasan Sahin, Guy Le Lay, and Angel Rubio. Introduction to the Physics of Silicene and other 2D Materials. Springer International Publishing, 2017. http://dx.doi.org/10.1007/978-3-319-46572-2.

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Vogt, Patrick, and Guy Le Lay. Silicene: Prediction, Synthesis, Application. Springer, 2018.

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Spencer, Michelle, and Tetsuya Morishita. Silicene: Structure, Properties and Applications. Springer London, Limited, 2016.

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Spencer, Michelle, and Tetsuya Morishita. Silicene: Structure, Properties and Applications. Springer International Publishing AG, 2016.

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Spencer, Michelle, and Tetsuya Morishita. Silicene: Structure, Properties and Applications. Springer, 2018.

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Lin, Ming-Fa. Silicene-Based Layered Materials: Essential Properties. Iop Publishing Ltd, 2020.

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Rubio, Angel, Seymur Cahangirov, Hasan Sahin, and Guy Le Lay. Introduction to the Physics of Silicene and Other 2D Materials. Springer, 2016.

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Rubio, Angel, Seymur Cahangirov, Hasan Sahin, and Guy Le Lay. Introduction to the Physics of Silicene and other 2D Materials. Springer, 2016.

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Buchteile zum Thema "Silicène"

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Lew Yan Voon, Lok C. "Physical Properties of Silicene." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_1.

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Yildirim, Handan, and Abdelkader Kara. "Computational Studies of Silicene on Silver Surfaces." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_10.

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Du, Yi, and Xun Xu. "Adsorption of Molecules on Silicene." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_11.

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Fleurence, Antoine. "Epitaxial Silicene: Beyond Silicene on Silver Substrates." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_12.

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Ezawa, Motohiko. "Topological Physics of Honeycomb Dirac Systems." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_2.

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Morishita, Tetsuya, and Michelle J. S. Spencer. "Free-Standing Multilayer Silicene: Molecular-Dynamics and Density Functional Theory Studies." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_3.

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Nakano, Hideyuki, and Masataka Ohashi. "Soft Chemical Synthesis of Functionalized Silicene." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_4.

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Spencer, Michelle J. S., and Tetsuya Morishita. "Theoretical Studies of Functionalised Silicene." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_5.

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Houssa, Michel, André Stesmans, and Valeri V. Afanas’ev. "Interaction Between Silicene and Non-metallic Surfaces." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_6.

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Takagi, Noriaki, Chun Liang Lin, and Ryuichi Arafune. "Silicene on Ag(111): Structure Evolution and Electronic Structure." In Silicene. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-28344-9_7.

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Konferenzberichte zum Thema "Silicène"

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Shah, Muzamil, Muhammad Qasim Mehmood, and Yehia Massoud. "A Study to Investigate Monolayer-Silicene’s Ability to Realize Tuneable Beam Shifts." In Frontiers in Optics. Optica Publishing Group, 2022. http://dx.doi.org/10.1364/fio.2022.jtu5b.23.

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We theoretically predict the tunable mechanical beam shifts on the surface of monolayer silicene in the presence of optical and electric fields. This unique ability of monolayer silicene can find exciting applications in biosensing and information processing.
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Prokhorenko, A., A. Gnidenko, A. Chibisov, and M. Chibisova. "QUANTUM-MECHANICAL STUDY OF THE SUBSTITUTION AND ADSORPTION OF P ATOMS ON SILICENE." In Mathematical modeling in materials science of electronic component. LCC MAKS Press, 2022. http://dx.doi.org/10.29003/m3095.mmmsec-2022/143-146.

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Using quantum mechanical calculations, the binding energies of silicene with phosphorus atoms adsorbed on its surface was determined. The most favorable mutual arrangement of phosphorus atoms on the surface of silicene has been revealed. The change in the charge and local magnetic moment on phosphorus atoms depending on the specified configurations has been studied.
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Prokhorenko, Anastasia, Anton Gnidenko, Andrey Chibisov, and Maria Chibisova. "ORDERED BEHAVIOR OF PHOSPHORUS ATOMS ON THE SURFACE OF SILICENE: DFT CALCULATIONS." In Mathematical modeling in materials science of electronic component. LCC MAKS Press, 2023. http://dx.doi.org/10.29003/m3608.mmmsec-2023/136-140.

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In this study, we employed quantum mechanical calculations to investigate the behavior of phosphorus atoms on the surface of a 2D silicon, known as silicene. We conducted a detailed analysis of the changes in binding energy for the adsorption or substitution of one or two phosphorus atoms on the silicene surface. Additionally, we determined the activation energies for diffusion in the cases of single and diatomic adsorption.
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Yuan, Feng, and Xingang Liang. "Thermal Management in Silicene Nanosheets With Designed Cavities by Molecular Dynamic Simulations." In ASME 2016 5th International Conference on Micro/Nanoscale Heat and Mass Transfer. American Society of Mechanical Engineers, 2016. http://dx.doi.org/10.1115/mnhmt2016-6487.

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Silicene, the silicon-based two-dimensional structure with honeycomb lattice, has been discovered to have tremendous application potential in fundamental industries. However, the thermal transport mechanism and thermal properties of silicene has not been fully explained. We report a possible way to control the thermal transport and thermal rectification in silicene nanosheets by designing distributions of a series of triangular cavities in this paper with the nonequilibrium molecular dynamic simulations. The cavities are arranged in a staggered way. The reflection of phonon at the vertex and t
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Pamungkas, Mauludi Ariesto, Dessy Anggraeni Setyowati, and Abdurrouf. "Optical properties of Ga-doped silicene and as-doped silicene: First principle calculations." In THE 8TH ANNUAL BASIC SCIENCE INTERNATIONAL CONFERENCE: Coverage of Basic Sciences toward the World’s Sustainability Challanges. Author(s), 2018. http://dx.doi.org/10.1063/1.5062764.

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Ezawa, Motohiko. "Silicene: Silicon-Based Topological Materials." In Proceedings of the International Symposium “Nanoscience and Quantum Physics 2012” (nanoPHYS’12). Journal of the Physical Society of Japan, 2015. http://dx.doi.org/10.7566/jpscp.4.012001.

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Lay, Guy Le, Seymur Cahangirov, Lede Xian, and Angel Rubio. "Silicene phases on Ag(111)." In 2014 International Conference on Manipulation, Manufacturing and Measurement on the Nanoscale (3M-NANO). IEEE, 2014. http://dx.doi.org/10.1109/3m-nano.2014.7057339.

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Pandey, Dhanshree, C. Kamal, and Aparna Chakrabarti. "Transition metal intercalated bilayer silicene." In DAE SOLID STATE PHYSICS SYMPOSIUM 2017. Author(s), 2018. http://dx.doi.org/10.1063/1.5028727.

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Silva, Jailson Gomes da, Luiz Antônio Ribeiro Junior, Geraldo Magela e. Silva, and Antônio Luciano de Almeida Fonseca. "Electron-Phonon Coupling in Silicene Nanoribbons." In VII Simpósio de Estrutura Eletrônica e Dinâmica Molecular. Editora Letra1, 2018. http://dx.doi.org/10.21826/9788563800374070.

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Cinquanta, Eugenio, Guido Fratesi, Stefano dal Conte, et al. "Ultrafast carrier dynamics of epitaxial silicene." In SPIE OPTO, edited by Markus Betz and Abdulhakem Y. Elezzabi. SPIE, 2017. http://dx.doi.org/10.1117/12.2252009.

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