{"id":828,"date":"2025-10-21T14:11:39","date_gmt":"2025-10-21T05:11:39","guid":{"rendered":"https:\/\/dept.tus.ac.jp\/st-ca\/?p=828"},"modified":"2025-10-21T14:11:40","modified_gmt":"2025-10-21T05:11:40","slug":"%e5%bd%93%e5%ad%a6%e7%a7%91-%e6%95%99%e5%93%a1%e3%82%89%e3%81%ae%e5%ad%a6%e8%a1%93%e8%ab%96%e6%96%87%e3%81%8c%e3%82%a2%e3%83%a1%e3%83%aa%e3%82%ab%e5%8c%96%e5%ad%a6%e4%bc%9a%e7%99%ba%e8%a1%8c%e3%80%8et","status":"publish","type":"post","link":"https:\/\/dept.tus.ac.jp\/st-ca\/news-list\/828\/","title":{"rendered":"\u5f53\u5b66\u79d1 \u6559\u54e1\u3089\u306e\u5b66\u8853\u8ad6\u6587\u304c\u30a2\u30e1\u30ea\u30ab\u5316\u5b66\u4f1a\u767a\u884c\u300eThe Journal of Physical Chemistry C\u300f\u8a8c\u306eSupplementary Cover\u306b\u9078\u51fa"},"content":{"rendered":"\n<p>\u4e95\u624b\u672c \u5eb7 \u6559\u6388\uff08\u526f\u5b66\u9577\uff09\u3089\u306e\u5b66\u8853\u8ad6\u6587\u304c\u30a2\u30e1\u30ea\u30ab\u5316\u5b66\u4f1a\u767a\u884c\u300eThe Journal of Physical Chemistry C\u300f\u8a8c\u306eSupplementary Cover\u306b\u9078\u51fa\u3055\u308c\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<p><strong>\u53d7\u8cde\u8005\uff1a<\/strong><br>\u526f\u5b66\u9577\uff0f\u5275\u57df\u7406\u5de5\u5b66\u90e8\u3000\u5148\u7aef\u5316\u5b66\u79d1\u3000\u6559\u6388\u3000\u4e95\u624b\u672c \u5eb7<br>\u5275\u57df\u7406\u5de5\u5b66\u90e8\u3000\u5148\u7aef\u5316\u5b66\u79d1\u3000\u51c6\u6559\u6388\u3000\u5317\u6751 \u5c1a\u6597<br>\u5275\u57df\u7406\u5de5\u5b66\u90e8\u3000\u5148\u7aef\u5316\u5b66\u79d1\u3000\u52a9\u6559\u3000\u77f3\u6a4b \u5343\u6676<\/p>\n\n\n\n<p><strong>\u63b2\u8f09\u30ab\u30d0\u30fc\uff1a<\/strong><br><a href=\"https:\/\/pubs.acs.org\/cms\/10.1021\/jpccck.2025.129.issue-36\/asset\/jpccck.2025.129.issue-36.xlargecover-2.jpg\" target=\"_blank\" rel=\"noreferrer noopener\">\u300eThe Journal of Physical Chemistry C\u300f\u8a8c Supplementary Cover<\/a><\/p>\n\n\n\n<p><strong>\u63b2\u8f09\u8ad6\u6587\uff1a<\/strong><br><a href=\"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jpcc.5c03254\" target=\"_blank\" rel=\"noreferrer noopener\">First-Principles Study of Stable Local Structures and Mg Insertion\/Detachment Mechanism During Charge\u2212Discharge of Spinel Mg(Co, Ni, Mn, Al)2O4 as Cathode Materials of Magnesium Secondary Batteries<\/a><\/p>\n\n\n\n<p><strong>\u5185\u5bb9\uff1a<\/strong><br>During charging and discharging, Mg<sup>2+<\/sup> diffuses between the 4- and 6-coordinated sites within the spinel-type structure Mg(Co,Ni,Mn,Al)<sub>2<\/sub>O<sub>4<\/sub>. Calculation of the radial distribution function using a graph neural network force field suggests that Mg<sup>2+<\/sup> moves within the crystal and changes to 6-coordination, especially during discharge, which reduces the peak derived from the 4-coordinated Mg\u2012Mg bonds.<\/p>\n\n\n\n<p><strong>\u63b2\u8f09\u65e5\uff1a<\/strong>\u30002025\u5e749\u670811\u65e5<\/p>\n\n\n\n<p><strong>\u95a2\u9023\u30ea\u30f3\u30af<\/strong><br><a href=\"https:\/\/pubs.acs.org\/journal\/jpccck\" target=\"_blank\" rel=\"noreferrer noopener\">The Journal of Physical Chemistry C<\/a><\/p>\n\n\n\n<p><strong>\u4e95\u624b\u672c\u30fb\u5317\u6751\u7814\u7a76\u5ba4<\/strong><br><a href=\"https:\/\/tus-idemoto.com\/\" target=\"_blank\" rel=\"noreferrer noopener\">\u7814\u7a76\u5ba4\u306e\u30da\u30fc\u30b8<\/a><br><a href=\"https:\/\/www.tus.ac.jp\/ridai\/doc\/ji\/RIJIA01Detail.php?act=pos&amp;kin=ken&amp;diu=BA9\" target=\"_blank\" rel=\"noreferrer noopener\">\u4e95\u624b\u672c\u526f\u5b66\u9577\u306e\u30da\u30fc\u30b8<\/a><br><a href=\"https:\/\/www.tus.ac.jp\/ridai\/doc\/ji\/RIJIA01Detail.php?act=pos&amp;kin=ken&amp;diu=524b\" target=\"_blank\" rel=\"noreferrer noopener\">\u5317\u6751\u51c6\u6559\u6388\u306e\u30da\u30fc\u30b8<\/a><br><a href=\"https:\/\/www.tus.ac.jp\/ridai\/doc\/ji\/RIJIA01Detail.php?act=pos&amp;kin=ken&amp;diu=6df5\" target=\"_blank\" rel=\"noreferrer noopener\">\u77f3\u6a4b\u52a9\u6559\u306e\u30da\u30fc\u30b8<\/a><\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.tus.ac.jp\/today\/archive\/2025\/20250925_0007.jpg\" alt=\"\u672c\u5b66\u526f\u5b66\u9577\u53ca\u3073\u6559\u54e1\u3089\u306e\u5b66\u8853\u8ad6\u6587\u304c\u30a2\u30e1\u30ea\u30ab\u5316\u5b66\u4f1a\u767a\u884c\u300eThe Journal of Physical Chemistry C\u300f\u8a8c\u306eSupplementary Cover\u306b\u9078\u51fa\" \/><\/figure>\n","protected":false},"excerpt":{"rendered":"<p>\u4e95\u624b\u672c \u5eb7 \u6559\u6388\uff08\u526f\u5b66\u9577\uff09\u3089\u306e\u5b66\u8853\u8ad6\u6587\u304c\u30a2\u30e1\u30ea\u30ab\u5316\u5b66\u4f1a\u767a\u884c\u300eThe Journal of Physical Chemistry C\u300f\u8a8c\u306eSupplementary Cover\u306b\u9078\u51fa\u3055\u308c\u307e\u3057\u305f\u3002 \u53d7\u8cde\u8005\uff1a\u526f\u5b66\u9577\uff0f\u5275\u57df\u7406\u5de5\u5b66 [&hellip;]<\/p>\n","protected":false},"author":153,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"_acf_changed":false,"footnotes":""},"categories":[3],"tags":[],"class_list":["post-828","post","type-post","status-publish","format-standard","hentry","category-news-list"],"acf":[],"aioseo_notices":[],"_links":{"self":[{"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/posts\/828","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/users\/153"}],"replies":[{"embeddable":true,"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/comments?post=828"}],"version-history":[{"count":1,"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/posts\/828\/revisions"}],"predecessor-version":[{"id":829,"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/posts\/828\/revisions\/829"}],"wp:attachment":[{"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/media?parent=828"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/categories?post=828"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/dept.tus.ac.jp\/st-ca\/wp-json\/wp\/v2\/tags?post=828"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}