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Disordering in Stone—Wales Graphene at High Temperatures
Thermally activated structural disordering is numerically studied in Stone—Wales graphene, which is a recently predicted new allotropic modification of graphene. The elastic characteristics of this material are analyzed. The Young modulus ( E= 857 GPa) and Poisson ratio (ν = 0.39) are determined. De...
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Published in: | JETP letters 2019-06, Vol.109 (11), p.710-714 |
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creator | Openov, L. A. Podlivaev, A. I. |
description | Thermally activated structural disordering is numerically studied in Stone—Wales graphene, which is a recently predicted new allotropic modification of graphene. The elastic characteristics of this material are analyzed. The Young modulus (
E=
857 GPa) and Poisson ratio (ν = 0.39) are determined. Defect formation processes under strong heating are studied by the real-time molecular dynamics method. It is demonstrated that melting begins with the formation of large windows in the monolayer and splitting of transversely oriented carbon chains from it. A criterion for the melting of two-dimensional systems is used to analyze the results. The upper estimate for the melting temperature is about 3800 K, which is much lower than the corresponding value for graphene. |
doi_str_mv | 10.1134/S0021364019110110 |
format | article |
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E=
857 GPa) and Poisson ratio (ν = 0.39) are determined. Defect formation processes under strong heating are studied by the real-time molecular dynamics method. It is demonstrated that melting begins with the formation of large windows in the monolayer and splitting of transversely oriented carbon chains from it. A criterion for the melting of two-dimensional systems is used to analyze the results. The upper estimate for the melting temperature is about 3800 K, which is much lower than the corresponding value for graphene.</description><identifier>ISSN: 0021-3640</identifier><identifier>EISSN: 1090-6487</identifier><identifier>DOI: 10.1134/S0021364019110110</identifier><language>eng</language><publisher>Moscow: Pleiades Publishing</publisher><subject>Allotropy ; Atomic ; Biological and Medical Physics ; Biophysics ; Chain scission ; Condensed Matter ; Graphene ; Melt temperature ; Melting ; Modulus of elasticity ; Molecular ; Molecular dynamics ; Numerical prediction ; Optical and Plasma Physics ; Particle and Nuclear Physics ; Physics ; Physics and Astronomy ; Poisson's ratio ; Quantum Information Technology ; Solid State Physics ; Spintronics ; Stone ; Two dimensional analysis</subject><ispartof>JETP letters, 2019-06, Vol.109 (11), p.710-714</ispartof><rights>Pleiades Publishing, Inc. 2019</rights><rights>Copyright Springer Nature B.V. 2019</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c316t-105c904c9840bc6dc89d45ae44636c1dd8b0f9f96b34f11705fe7e0c11c518ff3</citedby><cites>FETCH-LOGICAL-c316t-105c904c9840bc6dc89d45ae44636c1dd8b0f9f96b34f11705fe7e0c11c518ff3</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><link.rule.ids>314,776,780,27903,27904</link.rule.ids></links><search><creatorcontrib>Openov, L. A.</creatorcontrib><creatorcontrib>Podlivaev, A. I.</creatorcontrib><title>Disordering in Stone—Wales Graphene at High Temperatures</title><title>JETP letters</title><addtitle>Jetp Lett</addtitle><description>Thermally activated structural disordering is numerically studied in Stone—Wales graphene, which is a recently predicted new allotropic modification of graphene. The elastic characteristics of this material are analyzed. The Young modulus (
E=
857 GPa) and Poisson ratio (ν = 0.39) are determined. Defect formation processes under strong heating are studied by the real-time molecular dynamics method. It is demonstrated that melting begins with the formation of large windows in the monolayer and splitting of transversely oriented carbon chains from it. A criterion for the melting of two-dimensional systems is used to analyze the results. The upper estimate for the melting temperature is about 3800 K, which is much lower than the corresponding value for graphene.</description><subject>Allotropy</subject><subject>Atomic</subject><subject>Biological and Medical Physics</subject><subject>Biophysics</subject><subject>Chain scission</subject><subject>Condensed Matter</subject><subject>Graphene</subject><subject>Melt temperature</subject><subject>Melting</subject><subject>Modulus of elasticity</subject><subject>Molecular</subject><subject>Molecular dynamics</subject><subject>Numerical prediction</subject><subject>Optical and Plasma Physics</subject><subject>Particle and Nuclear Physics</subject><subject>Physics</subject><subject>Physics and Astronomy</subject><subject>Poisson's ratio</subject><subject>Quantum Information Technology</subject><subject>Solid State Physics</subject><subject>Spintronics</subject><subject>Stone</subject><subject>Two dimensional analysis</subject><issn>0021-3640</issn><issn>1090-6487</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2019</creationdate><recordtype>article</recordtype><recordid>eNp1kMFKw0AQhhdRsFYfwFvAc3Qmu9nNepOqrVDw0IrHsNnMtiltEnfTgzcfwif0SUyo4EGEgTn83_8P8zN2iXCNyMXNAiBBLgWgRoR-jtgIQUMsRaaO2WiQ40E_ZWchbKBHMq5G7Pa-Co0vyVf1KqrqaNE1NX19fL6aLYVo6k27ppoi00WzarWOlrRryZtu7ymcsxNntoEufvaYvTw-LCezeP48fZrczWPLUXYxQmo1CKszAYWVpc10KVJDQkguLZZlVoDTTsuCC4eoIHWkCCyiTTFzjo_Z1SG39c3bnkKXb5q9r_uTeZKoREmOWvUUHijrmxA8ubz11c749xwhHyrK_1TUe5KDJ7TD_-R_k_83fQP6iWcz</recordid><startdate>20190601</startdate><enddate>20190601</enddate><creator>Openov, L. A.</creator><creator>Podlivaev, A. I.</creator><general>Pleiades Publishing</general><general>Springer Nature B.V</general><scope>AAYXX</scope><scope>CITATION</scope></search><sort><creationdate>20190601</creationdate><title>Disordering in Stone—Wales Graphene at High Temperatures</title><author>Openov, L. A. ; Podlivaev, A. I.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c316t-105c904c9840bc6dc89d45ae44636c1dd8b0f9f96b34f11705fe7e0c11c518ff3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2019</creationdate><topic>Allotropy</topic><topic>Atomic</topic><topic>Biological and Medical Physics</topic><topic>Biophysics</topic><topic>Chain scission</topic><topic>Condensed Matter</topic><topic>Graphene</topic><topic>Melt temperature</topic><topic>Melting</topic><topic>Modulus of elasticity</topic><topic>Molecular</topic><topic>Molecular dynamics</topic><topic>Numerical prediction</topic><topic>Optical and Plasma Physics</topic><topic>Particle and Nuclear Physics</topic><topic>Physics</topic><topic>Physics and Astronomy</topic><topic>Poisson's ratio</topic><topic>Quantum Information Technology</topic><topic>Solid State Physics</topic><topic>Spintronics</topic><topic>Stone</topic><topic>Two dimensional analysis</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Openov, L. A.</creatorcontrib><creatorcontrib>Podlivaev, A. I.</creatorcontrib><collection>CrossRef</collection><jtitle>JETP letters</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Openov, L. A.</au><au>Podlivaev, A. I.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Disordering in Stone—Wales Graphene at High Temperatures</atitle><jtitle>JETP letters</jtitle><stitle>Jetp Lett</stitle><date>2019-06-01</date><risdate>2019</risdate><volume>109</volume><issue>11</issue><spage>710</spage><epage>714</epage><pages>710-714</pages><issn>0021-3640</issn><eissn>1090-6487</eissn><abstract>Thermally activated structural disordering is numerically studied in Stone—Wales graphene, which is a recently predicted new allotropic modification of graphene. The elastic characteristics of this material are analyzed. The Young modulus (
E=
857 GPa) and Poisson ratio (ν = 0.39) are determined. Defect formation processes under strong heating are studied by the real-time molecular dynamics method. It is demonstrated that melting begins with the formation of large windows in the monolayer and splitting of transversely oriented carbon chains from it. A criterion for the melting of two-dimensional systems is used to analyze the results. The upper estimate for the melting temperature is about 3800 K, which is much lower than the corresponding value for graphene.</abstract><cop>Moscow</cop><pub>Pleiades Publishing</pub><doi>10.1134/S0021364019110110</doi><tpages>5</tpages></addata></record> |
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subjects | Allotropy Atomic Biological and Medical Physics Biophysics Chain scission Condensed Matter Graphene Melt temperature Melting Modulus of elasticity Molecular Molecular dynamics Numerical prediction Optical and Plasma Physics Particle and Nuclear Physics Physics Physics and Astronomy Poisson's ratio Quantum Information Technology Solid State Physics Spintronics Stone Two dimensional analysis |
title | Disordering in Stone—Wales Graphene at High Temperatures |
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