{"id":254741,"date":"2023-09-28T08:44:23","date_gmt":"2023-09-28T00:44:23","guid":{"rendered":"http:\/\/www.cailiaoniu.com\/?p=254741"},"modified":"2023-09-28T08:44:23","modified_gmt":"2023-09-28T00:44:23","slug":"acs-nano%ef%bc%9a%e5%88%a9%e7%94%a8%e8%a1%a8%e9%9d%a2%e6%b0%a2%e5%8c%96%e6%8a%80%e6%9c%af%e5%ae%9e%e7%8e%b0%e7%ba%b3%e7%b1%b3%e7%9f%b3%e5%a2%a8%e7%83%b7%e7%9a%84%e5%88%b6%e5%a4%87","status":"publish","type":"post","link":"http:\/\/www.cailiaoniu.com\/?p=254741","title":{"rendered":"ACS Nano\uff1a\u5229\u7528\u8868\u9762\u6c22\u5316\u6280\u672f\u5b9e\u73b0\u7eb3\u7c73\u77f3\u58a8\u70f7\u7684\u5236\u5907"},"content":{"rendered":"

\u7eb3\u7c73\u77f3\u58a8\u70f7\u4f5c\u4e3a\u4e00\u79cdsp3<\/sup>\u6742\u5316\u7684\u78b3\u7eb3\u7c73\u6750\u6599\uff0c\u6709\u671b\u5177\u6709\u589e\u5f3a\u7684\u7535\u5b50-\u58f0\u5b50\u76f8\u4e92\u4f5c\u7528\uff0c\u8fd9\u5728\u7a7a\u7a74\u63ba\u6742\u8d85\u5bfc\u3001\u5149\u7535\u53d1\u5c04\u7279\u6027\u7b49\u65b9\u9762\u53d1\u6325\u7740\u91cd\u8981\u4f5c\u7528\uff0c\u53ef\u4e3a\u7eb3\u7c73\u5c3a\u5ea6\u7684\u78b3\u57fa\u7535\u5b50\u5668\u4ef6\u7684\u53d1\u5c55\u63d0\u4f9b\u66f4\u591a\u7684\u53ef\u80fd\u6027\u3002\u56e0\u6b64\uff0c\u539f\u5b50\u7cbe\u5ea6\u7684\u7eb3\u7c73\u77f3\u58a8\u70f7\u7684\u5236\u5907\u53d8\u5f97\u5c24\u4e3a\u91cd\u8981\u3002\u7814\u7a76\u53d1\u73b0\uff0c\u7eb3\u7c73\u77f3\u58a8\u70ef\u7684\u6c22\u5316\u662f\u83b7\u5f97\u7eb3\u7c73\u77f3\u58a8\u70f7\u7684\u6709\u6548\u9014\u5f84\u4e4b\u4e00\u3002<\/p>\n

\u5317\u4eac\u7406\u5de5\u5927\u5b66\u674e\u5a1f\u52a9\u7406\u6559\u6388\u8054\u5408\u4e2d\u79d1\u9662\u7269\u7406\u6240CA Palma\u7279\u8058\u7814\u7a76\u5458\u3001\u9a6c\u666e\u6240Klaus M\u00fcllen\u6559\u6388\uff0c\u5229\u7528\u6c22\u7b49\u79bb\u5b50\u4f53\u548c\u6c22\u6e90\u65b9\u5f0f\u5bf9<\/strong>\u591a\u73af\u82b3\u70c3\u5316\u5408\u7269\u8fdb\u884c\u8868\u9762\u6c22\u5316\u5904\u7406\uff0c\u5c06\u6750\u6599\u4ecesp2<\/sup>\u6742\u5316\u8f6c\u53d8\u4e3asp3<\/sup>\u6742\u5316\uff0c\u6210\u529f\u5b9e\u73b0\u4e86\u7eb3\u7c73\u77f3\u58a8\u70f7\u7684\u5236\u5907\u3002\u76f8\u5173\u5de5\u4f5c\u4ee5\u201c Hydrogenation of hexa-peri-hexabenzocoronene: An entry to nanographanes and nanodiamonds\u201d\u4e3a\u9898\u53d1\u8868\u5728\u9876\u7ea7\u671f\u520aACS Nano\uff0810.1021\/acsnano.3c03538\uff09\u4e0a\u3002\u8bba\u6587\u7b2c\u4e00\u4f5c\u8005\u4e3a\u5317\u4eac\u7406\u5de5\u5927\u5b66\u7269\u7406\u5b66\u9662\u535a\u58eb\u751f\u738b\u598d\uff0c\u901a\u8baf\u4f5c\u8005\u4e3a\u5317\u4eac\u7406\u5de5\u5927\u5b66\u674e\u5a1f\u52a9\u7406\u6559\u6388\uff0c\u4e2d\u79d1\u9662\u7269\u7406\u6240CA Palma\uff0c\u9a6c\u666e\u6240Klaus M\u00fcllen\u6559\u6388\u3002<\/p>\n

\"\"<\/p>\n

\u3010\u56fe\u6587\u5bfc\u8bfb\u3011<\/p>\n

\"\"<\/p>\n

\u56fe1\uff1a\u6c22\u6e90\u5904\u7406\u524d\u540enaphthalene\u5206\u5b50\u7684\u5b9e\u9a8c\u8868\u5f81\u7ed3\u679c<\/p>\n

\u9996\u5148\uff0c\u4f5c\u8005\u7528\u6c22\u6e90\u5bf9naphthalene\u5206\u5b50\u8fdb\u884c\u4e86\u6c22\u5316\u5904\u7406\uff08\u56fe1a\uff09\u3002\u62c9\u66fc\u5149\u8c31\u7ed3\u679c\uff08\u56fe1b\uff09\u8868\u660e\uff0c\u6c22\u5316\u524d\u540e\u7684naphthalene\u5206\u5b50\u8868\u73b0\u51fa\u622a\u7136\u4e0d\u540c\u7684\u7279\u5f81\u5cf0\uff0c\u6c22\u5316\u540e\u7684\u62c9\u66fc\u4fe1\u53f7~2900 cm-1<\/sup>\u4e0edecalin\u5206\u5b50\uff08\u5bf9\u5e94\u5b8c\u5168\u6c22\u5316\u7684naphthalene\u5206\u5b50\uff09\u76f8\u4e00\u81f4\u3002\u540c\u65f6\uff0c\u98de\u884c\u65f6\u95f4\u8d28\u8c31\u4eea\u7684\u7ed3\u679c\uff08\u56fe1c\uff09\u8868\u660e\uff0c\u6c22\u5316\u540e\u65b0\u7684\u8d28\u8c31\u5cf0m\/z = 138\u4e0edecalin\u5206\u5b50\u76f8\u4e00\u81f4\uff0c\u4e24\u79cd\u8868\u5f81\u624b\u6bb5\u5747\u8bc1\u5b9e\u90e8\u5206naphthalene\u5206\u5b50\u88ab\u5b8c\u5168\u6c22\u5316\u3002\u7531\u6b64\u53ef\u77e5\uff0c\u6c22\u6e90\u53ef\u4ee5\u5b9e\u73b0naphthalene\u5206\u5b50\u7531sp2<\/sup>\u5411sp3<\/sup>\u7684\u5316\u5b66\u8f6c\u53d8\u3002<\/p>\n

\"\"<\/p>\n

\u56fe2\uff1a\u6c22\u6e90\u5904\u7406\u524d\u540eHBC\u5206\u5b50\u7684\u5b9e\u9a8c\u8868\u5f81\u7ed3\u679c<\/p>\n

\u7136\u540e\uff0c\u4f5c\u8005\u501f\u52a9\u4f4e\u6e29\u626b\u63cf\u96a7\u9053\u663e\u5fae\u955c\u548c\u62c9\u66fc\u5149\u8c31\u4eea\u7814\u7a76\u4e86\u6c22\u6e90\u5bf9HBC\u5206\u5b50\u7684\u6c22\u5316\u6548\u679c\u3002\u8d85\u9ad8\u771f\u7a7a\u6761\u4ef6\u4e0b\u5229\u7528\u5206\u5b50\u675f\u5916\u5ef6\u6280\u672f\u5f97\u5230\u7684HBC\u5355\u5206\u5b50\u5c42\uff08\u56fe2a\uff09\u5728\u7ecf\u8fc7\u56db\u5c0f\u65f6\u7684\u6c22\u5316\u5904\u7406\u540e\uff0c\u8868\u9762\u51fa\u73b0\u660e\u4eae\u7684\u51f8\u8d77\u7f3a\u9677\uff08\u56fe2b-d\uff09\uff0c\u8fd9\u88ab\u8ba4\u4e3a\u662f\u5206\u5b50\u5c40\u90e8\u6c22\u5316\u9020\u6210\u3002\u5c40\u90e8\u6c22\u5316\u7684HBC\u5206\u5b50\u5f0f\uff08\u56fe2f\uff09\u8868\u660e\u4e86\u6f5c\u5728\u7684\u52a0\u6c22\u4f4d\u70b9\uff08\u7ea2\u8272\u6c22\u539f\u5b50\uff09\uff0c\u4e0e\u4f4e\u6e29\u626b\u63cf\u96a7\u9053\u663e\u5fae\u955c\u6052\u9ad8\u6a21\u5f0f\u4e0b\u83b7\u5f97\u7684\u9ad8\u5206\u8fa8\u7387\u56fe\u50cf\u7ed3\u679c\u4e00\u81f4\u3002\u540c\u65f6\uff0c\u6c22\u6e90\u5904\u7406\u540e\u7684HBC\u5206\u5b50\u5728\u62c9\u66fc\u5149\u8c31\u4e2d\u4e5f\u8868\u73b0\u51fasp3<\/sup>\u78b3\u6750\u6599\u7684\u7279\u5f81\u5cf0~1375 cm-1<\/sup> (\u56fe2g)\uff0c\u8fdb\u4e00\u6b65\u8bc1\u5b9e\u4e86HBC\u5206\u5b50\u7684\u6c22\u5316\u3002<\/p>\n

\"\"<\/p>\n

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\u63a5\u4e0b\u6765\u7528\u4f4e\u6e29\u626b\u63cf\u96a7\u9053\u663e\u5fae\u955c\u3001\u62c9\u66fc\u5149\u8c31\u4eea\u548c\u98de\u884c\u65f6\u95f4\u8d28\u8c31\u4eea\u5bf9\u6c22\u7b49\u79bb\u5b50\u4f53\u6e90\u5904\u7406\u7684HBC\u6837\u54c1\u8fdb\u884c\u4e86\u5206\u6790\u3002\u5728\u8d28\u8c31\u7ed3\u679c\uff08\u56fe3d\uff09\u4e2d\uff0c\u6c22\u5316\u5904\u7406\u540e\u7684\u6837\u54c1\u51fa\u73b0\u65b0\u7684\u5cf0\u503cm\/z = 564\uff0c\u4e0e\u5b8c\u5168\u6c22\u5316\u7684HBC\u5206\u5b50\u7406\u8bba\u503c\u4e00\u81f4\uff0c\u8868\u660e\u6c22\u7b49\u79bb\u5b50\u4f53\u6e90\u5904\u7406\u7684\u6837\u54c1\u4e2d\u5b58\u5728\u5b8c\u5168\u6c22\u5316\u7684HBC\u5206\u5b50\u3002\u62c9\u66fc\u5149\u8c31\u7ed3\u679c\uff08\u56fe3c\uff09\u4e2d\uff0csp3<\/sup>\u78b3\u6750\u6599\u7684\u7279\u5f81\u5cf0~1375 cm-1<\/sup>\u8fdb\u4e00\u6b65\u8bc1\u5b9e\u4e86\u6c22\u5316\u53cd\u5e94\u7684\u53d1\u751f\u3002\u503c\u5f97\u6ce8\u610f\u7684\u662f\uff0cHBC\u591a\u5206\u5b50\u5c42\uff08\u56fe3a\uff09\u5728\u6c22\u7b49\u79bb\u5b50\u4f53\u6e90\u5904\u7406\u540e\u7528\u4f4e\u6e29\u626b\u63cf\u96a7\u9053\u663e\u5fae\u955c\u8fdb\u884c\u8868\u5f81\uff0c\u7ed3\u679c\uff08\u56fe3b\uff09\u663e\u793a\u6c22\u7b49\u79bb\u5b50\u4f53\u6e90\u4f1a\u9020\u6210\u90e8\u5206HBC\u5206\u5b50\u7684\u7834\u88c2\u3002<\/p>\n

\"\"<\/p>\n

\u56fe4\uff1aDFTB-MD\u6a21\u62dfHBC\u6c22\u5316\u8fc7\u7a0b<\/p>\n

\"\"<\/p>\n

\u56fe5\uff1aDFTB-MD\u6a21\u62dfHBC\u4e8c\u805a\u4f53\u6c22\u5316\u8fc7\u7a0b<\/p>\n

\u7528DFTB-MD\u5bf9HBC\u5206\u5b50\u7684\u6c22\u5316\u8fc7\u7a0b\u8fdb\u884c\u4e86\u7edf\u8ba1\u6027\u5206\u6790\uff0c\u8868\u660e\u5355\u4e2aHBC\u5206\u5b50\u7684\u6c22\u5316\u4e3b\u8981\u53d1\u751f\u5728\u524d\u51e0\u98de\u79d2\u5185\uff08\u56fe4\uff09\uff0c\u901a\u8fc7\u4e0e\u81ea\u7531\u57fa\u7684\u9ad8\u80fd\u78b0\u649e\u800c\u53d1\u751f\uff0c\u70ed\u5316\u5728\u7eb3\u7c73\u77f3\u58a8\u70f7\u7684\u5f62\u6210\u4e2d\u5e76\u4e0d\u5360\u636e\u4e3b\u5bfc\u5730\u4f4d\u3002\u5bf9\u5904\u4e8e\u5e94\u53d8\u72b6\u6001\u7684HBC\u5206\u5b50\u548c\u65e0\u7ea6\u675f\u72b6\u6001\u7684HBC\u5206\u5b50\u4e8c\u805a\u4f53\u8fdb\u884c\u7406\u8bba\u6a21\u62df\uff0c\u7ed3\u679c\u8868\u660e\u8be5\u65b9\u6cd5\u53ef\u83b7\u5f97\u7eb3\u7c73\u91d1\u521a\u77f3\uff0c\u4e14\u7eb3\u7c73\u91d1\u521a\u77f3\u7684\u5f62\u6210\u9075\u5faa\u70ed\u529b\u5b66\u7684\u63a7\u5236\uff08\u56fe5\uff09\u3002<\/p>\n

\u8fd9\u9879\u5de5\u4f5c\u4e2d\uff0c\u66b4\u9732\u4e8e\u6c22\u6e90\u7684naphthalene\u5206\u5b50\u548c\u66b4\u9732\u4e8e\u6c22\u7b49\u79bb\u5b50\u4f53\u6e90\u7684HBC\u5206\u5b50\u90fd\u5b9e\u73b0\u4e86\u5b8c\u5168\u6c22\u5316\uff0c\u5b8c\u6210\u4e86sp2<\/sup>\u5411sp3<\/sup>\u7684\u5316\u5b66\u8f6c\u53d8\uff0c\u4e3a\u6df7\u5408\u81ea\u4e0b\u800c\u4e0a\u3001\u81ea\u4e0a\u800c\u4e0b\u7684\u7eb3\u7c73\u77f3\u58a8\u70f7\u548c\u7eb3\u7c73\u91d1\u521a\u77f3\u5236\u9020\u7b56\u7565\u5960\u5b9a\u4e86\u57fa\u7840\u3002<\/p>\n

\u539f\u6587\u94fe\u63a5\uff1ahttps:\/\/doi.org\/10.1021\/acsnano.3c03538<\/a><\/p>\n

\u4f5c\u8005\u7b80\u4ecb\uff1a<\/p>\n

\u674e\u5a1f\uff0c\u5317\u4eac\u7406\u5de5\u5927\u5b66\u524d\u6cbf\u4ea4\u53c9\u79d1\u5b66\u7814\u7a76\u9662\u52a9\u7406\u6559\u6388\uff08\u7279\u522b\u526f\u7814\u7a76\u5458\uff09\uff0c\u535a\u58eb\u751f\u5bfc\u5e08\u3002\u535a\u58eb\u6bd5\u4e1a\u4e8e\u6155\u5c3c\u9ed1\u5de5\u4e1a\u5927\u5b66\uff0c\u4e3b\u8981\u4ece\u4e8b\u626b\u63cf\u63a2\u9488\u663e\u5fae\u955c\u3001\u8868\u754c\u9762\u5206\u5b50\u6784\u578b\u3001\u5206\u5b50\u7cbe\u5ea6\u5668\u4ef6\u7684\u7814\u7a76\u3002\u8fd1\u5e74\u6765\uff0c\u4ee5\u7b2c\u4e00\u4f5c\u8005\/\u901a\u8baf\u4f5c\u8005\u8eab\u4efd\u5728Nat. Commun.\u3001 J. Am. Chem. Soc.\u3001 Nano Lett.\u3001ACS Appl. Mater. Inter.\u3001Appl. Phys. Lett.\u7b49\u56fd\u9645\u8457\u540d\u671f\u520a\u53d1\u8868\u8bba\u658720\u4f59\u7bc7\uff0c\u4e3b\u6301\u56fd\u5bb6\u81ea\u7136\u79d1\u5b66\u57fa\u91d1\u7b49\u9879\u76ee\u3002<\/p>\n","protected":false},"excerpt":{"rendered":"

\u7eb3\u7c73\u77f3\u58a8\u70f7\u4f5c\u4e3a\u4e00\u79cdsp3\u6742\u5316\u7684\u78b3\u7eb3\u7c73\u6750\u6599\uff0c\u6709\u671b\u5177\u6709\u589e\u5f3a\u7684\u7535\u5b50-\u58f0\u5b50\u76f8\u4e92\u4f5c\u7528\uff0c\u8fd9\u5728\u7a7a\u7a74\u63ba\u6742\u8d85\u5bfc\u3001\u5149\u7535\u53d1\u5c04\u7279\u6027\u7b49\u65b9\u9762\u53d1\u6325\u7740\u91cd\u8981\u4f5c\u7528\uff0c\u53ef\u4e3a\u7eb3\u7c73\u5c3a\u5ea6\u7684\u78b3\u57fa\u7535\u5b50\u5668\u4ef6\u7684\u53d1\u5c55…<\/p>\n","protected":false},"author":2,"featured_media":0,"comment_status":"open","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[215],"tags":[],"class_list":["post-254741","post","type-post","status-publish","format-standard","hentry","category-jiedu"],"_links":{"self":[{"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=\/wp\/v2\/posts\/254741"}],"collection":[{"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=\/wp\/v2\/users\/2"}],"replies":[{"embeddable":true,"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=254741"}],"version-history":[{"count":1,"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=\/wp\/v2\/posts\/254741\/revisions"}],"predecessor-version":[{"id":254752,"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=\/wp\/v2\/posts\/254741\/revisions\/254752"}],"wp:attachment":[{"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=254741"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=254741"},{"taxonomy":"post_tag","embeddable":true,"href":"http:\/\/www.cailiaoniu.com\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=254741"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}