Microstructures and thermodynamic properties of high-entropy alloys CoCrCuFeNi
The high entropy alloys (HEAs) is a kind of innovative alloy design conception. However, seldom quantitative thermodynamics descriptions were reported in the past. In this paper, as a demonstration, the microstructures and thermodynamic properties of CoCrCuFeNi HEA were studied by combining experime...
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Veröffentlicht in: | Intermetallics 2018-02, Vol.93, p.40-46 |
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description | The high entropy alloys (HEAs) is a kind of innovative alloy design conception. However, seldom quantitative thermodynamics descriptions were reported in the past. In this paper, as a demonstration, the microstructures and thermodynamic properties of CoCrCuFeNi HEA were studied by combining experimental approaches with computational simulations. The CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase. With the increase of heat treatment temperature from 773 K to 1273 K, the predicted total configurational entropy changes from 6.13 to 7.83 J·mol−1·K−1, which is far less than the common-believed Boltzmann's hypothesis value (13.38 J·mol−1·K−1) due to the ordering behavior of element occupying on the sublattices. Cu atoms tend to enrich in liquid phase, which segregates as interdendritic microstructure during solidification process. The experimental results are highly consistent with the calculated results.
•The site fraction and the solidifying composition were investigated quantitatively.•CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase.•Cu tend to enrich in residual liquid phase to segregates as interdendritic.•Due to the ordering behavior of elements, the mixing entropy is 7.83 kJ/(mol·atom)/K at 1273 K. |
doi_str_mv | 10.1016/j.intermet.2017.10.018 |
format | Article |
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•The site fraction and the solidifying composition were investigated quantitatively.•CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase.•Cu tend to enrich in residual liquid phase to segregates as interdendritic.•Due to the ordering behavior of elements, the mixing entropy is 7.83 kJ/(mol·atom)/K at 1273 K.</description><identifier>ISSN: 0966-9795</identifier><identifier>EISSN: 1879-0216</identifier><identifier>DOI: 10.1016/j.intermet.2017.10.018</identifier><language>eng</language><publisher>Barking: Elsevier Ltd</publisher><subject>Ab initio calculations ; Alloy solidification ; Computer simulation ; Entropy ; Heat treatment ; High entropy alloys ; Microstructure ; Solidification process simulation ; Thermodynamic modeling ; Thermodynamic properties ; Thermodynamics</subject><ispartof>Intermetallics, 2018-02, Vol.93, p.40-46</ispartof><rights>2017 Elsevier Ltd</rights><rights>Copyright Elsevier BV Feb 2018</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c406t-ae3147bafa2921800406b8920118b4be79cb04f1e77197ce8786b9bb3e5818473</citedby><cites>FETCH-LOGICAL-c406t-ae3147bafa2921800406b8920118b4be79cb04f1e77197ce8786b9bb3e5818473</cites><orcidid>0000-0002-9455-7795</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktohtml>$$Uhttps://dx.doi.org/10.1016/j.intermet.2017.10.018$$EHTML$$P50$$Gelsevier$$H</linktohtml><link.rule.ids>314,777,781,3537,27905,27906,45976</link.rule.ids></links><search><creatorcontrib>Wu, Bo</creatorcontrib><creatorcontrib>Xie, Zheyu</creatorcontrib><creatorcontrib>Huang, Jinchang</creatorcontrib><creatorcontrib>Lin, Jinwei</creatorcontrib><creatorcontrib>Yang, Yixu</creatorcontrib><creatorcontrib>Jiang, Linqiao</creatorcontrib><creatorcontrib>Huang, Jianglin</creatorcontrib><creatorcontrib>Ye, Guoxin</creatorcontrib><creatorcontrib>Zhao, Chunfeng</creatorcontrib><creatorcontrib>Yang, Shangjin</creatorcontrib><creatorcontrib>Sa, Baisheng</creatorcontrib><title>Microstructures and thermodynamic properties of high-entropy alloys CoCrCuFeNi</title><title>Intermetallics</title><description>The high entropy alloys (HEAs) is a kind of innovative alloy design conception. However, seldom quantitative thermodynamics descriptions were reported in the past. In this paper, as a demonstration, the microstructures and thermodynamic properties of CoCrCuFeNi HEA were studied by combining experimental approaches with computational simulations. The CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase. With the increase of heat treatment temperature from 773 K to 1273 K, the predicted total configurational entropy changes from 6.13 to 7.83 J·mol−1·K−1, which is far less than the common-believed Boltzmann's hypothesis value (13.38 J·mol−1·K−1) due to the ordering behavior of element occupying on the sublattices. Cu atoms tend to enrich in liquid phase, which segregates as interdendritic microstructure during solidification process. The experimental results are highly consistent with the calculated results.
•The site fraction and the solidifying composition were investigated quantitatively.•CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase.•Cu tend to enrich in residual liquid phase to segregates as interdendritic.•Due to the ordering behavior of elements, the mixing entropy is 7.83 kJ/(mol·atom)/K at 1273 K.</description><subject>Ab initio calculations</subject><subject>Alloy solidification</subject><subject>Computer simulation</subject><subject>Entropy</subject><subject>Heat treatment</subject><subject>High entropy alloys</subject><subject>Microstructure</subject><subject>Solidification process simulation</subject><subject>Thermodynamic modeling</subject><subject>Thermodynamic properties</subject><subject>Thermodynamics</subject><issn>0966-9795</issn><issn>1879-0216</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2018</creationdate><recordtype>article</recordtype><recordid>eNqFUMtOwzAQtBBIlMIvoEicE-y8bN9AES1IpVzgbNnOhjpq42I7SPl7HBXOnFaanZmdHYRuCc4IJvV9n5khgDtAyHJMaAQzTNgZWhBGeYpzUp-jBeZ1nXLKq0t05X2PIxEX1QJtX4121gc36jA68Ikc2iTsop1tp0EejE6Ozh7BBROXtkt25nOXwhAiOCVyv7eTTxrbuGZcwdZco4tO7j3c_M4l-lg9vTfP6eZt_dI8blJd4jqkEgpSUiU7mfOcMIwjqhiP8QlTpQLKtcJlR4BSwqkGRlmtuFIFVIywkhZLdHfyjeG-RvBB9HZ0QzwpoknOCo6rKrLqE2t-0TvoxNGZg3STIFjM3Yle_HU36-iMx-6i8OEkhPjDtwEnvDYwaGiNAx1Ea81_Fj8BB3u0</recordid><startdate>201802</startdate><enddate>201802</enddate><creator>Wu, Bo</creator><creator>Xie, Zheyu</creator><creator>Huang, Jinchang</creator><creator>Lin, Jinwei</creator><creator>Yang, Yixu</creator><creator>Jiang, Linqiao</creator><creator>Huang, Jianglin</creator><creator>Ye, Guoxin</creator><creator>Zhao, Chunfeng</creator><creator>Yang, Shangjin</creator><creator>Sa, Baisheng</creator><general>Elsevier Ltd</general><general>Elsevier BV</general><scope>AAYXX</scope><scope>CITATION</scope><scope>8BQ</scope><scope>8FD</scope><scope>JG9</scope><orcidid>https://orcid.org/0000-0002-9455-7795</orcidid></search><sort><creationdate>201802</creationdate><title>Microstructures and thermodynamic properties of high-entropy alloys CoCrCuFeNi</title><author>Wu, Bo ; Xie, Zheyu ; Huang, Jinchang ; Lin, Jinwei ; Yang, Yixu ; Jiang, Linqiao ; Huang, Jianglin ; Ye, Guoxin ; Zhao, Chunfeng ; Yang, Shangjin ; Sa, Baisheng</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c406t-ae3147bafa2921800406b8920118b4be79cb04f1e77197ce8786b9bb3e5818473</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2018</creationdate><topic>Ab initio calculations</topic><topic>Alloy solidification</topic><topic>Computer simulation</topic><topic>Entropy</topic><topic>Heat treatment</topic><topic>High entropy alloys</topic><topic>Microstructure</topic><topic>Solidification process simulation</topic><topic>Thermodynamic modeling</topic><topic>Thermodynamic properties</topic><topic>Thermodynamics</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Wu, Bo</creatorcontrib><creatorcontrib>Xie, Zheyu</creatorcontrib><creatorcontrib>Huang, Jinchang</creatorcontrib><creatorcontrib>Lin, Jinwei</creatorcontrib><creatorcontrib>Yang, Yixu</creatorcontrib><creatorcontrib>Jiang, Linqiao</creatorcontrib><creatorcontrib>Huang, Jianglin</creatorcontrib><creatorcontrib>Ye, Guoxin</creatorcontrib><creatorcontrib>Zhao, Chunfeng</creatorcontrib><creatorcontrib>Yang, Shangjin</creatorcontrib><creatorcontrib>Sa, Baisheng</creatorcontrib><collection>CrossRef</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Materials Research Database</collection><jtitle>Intermetallics</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Wu, Bo</au><au>Xie, Zheyu</au><au>Huang, Jinchang</au><au>Lin, Jinwei</au><au>Yang, Yixu</au><au>Jiang, Linqiao</au><au>Huang, Jianglin</au><au>Ye, Guoxin</au><au>Zhao, Chunfeng</au><au>Yang, Shangjin</au><au>Sa, Baisheng</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Microstructures and thermodynamic properties of high-entropy alloys CoCrCuFeNi</atitle><jtitle>Intermetallics</jtitle><date>2018-02</date><risdate>2018</risdate><volume>93</volume><spage>40</spage><epage>46</epage><pages>40-46</pages><issn>0966-9795</issn><eissn>1879-0216</eissn><abstract>The high entropy alloys (HEAs) is a kind of innovative alloy design conception. However, seldom quantitative thermodynamics descriptions were reported in the past. In this paper, as a demonstration, the microstructures and thermodynamic properties of CoCrCuFeNi HEA were studied by combining experimental approaches with computational simulations. The CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase. With the increase of heat treatment temperature from 773 K to 1273 K, the predicted total configurational entropy changes from 6.13 to 7.83 J·mol−1·K−1, which is far less than the common-believed Boltzmann's hypothesis value (13.38 J·mol−1·K−1) due to the ordering behavior of element occupying on the sublattices. Cu atoms tend to enrich in liquid phase, which segregates as interdendritic microstructure during solidification process. The experimental results are highly consistent with the calculated results.
•The site fraction and the solidifying composition were investigated quantitatively.•CoCrCuFeNi alloy shows duplex FCC structure with Cu-lean and Cu-rich phase.•Cu tend to enrich in residual liquid phase to segregates as interdendritic.•Due to the ordering behavior of elements, the mixing entropy is 7.83 kJ/(mol·atom)/K at 1273 K.</abstract><cop>Barking</cop><pub>Elsevier Ltd</pub><doi>10.1016/j.intermet.2017.10.018</doi><tpages>7</tpages><orcidid>https://orcid.org/0000-0002-9455-7795</orcidid></addata></record> |
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subjects | Ab initio calculations Alloy solidification Computer simulation Entropy Heat treatment High entropy alloys Microstructure Solidification process simulation Thermodynamic modeling Thermodynamic properties Thermodynamics |
title | Microstructures and thermodynamic properties of high-entropy alloys CoCrCuFeNi |
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