{"id":174830,"date":"2019-05-14T06:30:01","date_gmt":"2019-05-13T22:30:01","guid":{"rendered":"\/\/m.iemloyee.com\/?p=174830"},"modified":"2019-05-13T19:46:32","modified_gmt":"2019-05-13T11:46:32","slug":"%e3%80%90%e9%80%9a%e8%ae%af%e4%bd%9c%e8%80%85%e4%b8%ba%e5%9b%bd%e5%a4%96%e6%9c%aa%e6%a0%a1%e7%a8%bf%e3%80%91nat-rev-chem-%e7%bb%bc%e8%bf%b0%e6%96%87%e7%ab%a0%ef%bc%9a%e5%a4%8d%e5%90%88%e4%bd%93","status":"publish","type":"post","link":"\/\/m.iemloyee.com\/?p=174830","title":{"rendered":"Nat. Rev. Chem.\u7efc\u8ff0\u6587\u7ae0\uff1a\u590d\u5408\u4f53\u7cfb\u4e2d\u5149\u9a71\u52a8\u8fc7\u7a0b\u7684\u591a\u5c3a\u5ea6\u6a21\u62df"},"content":{"rendered":"<p>\u3010\u5f15\u8a00\u3011<\/p>\n<p>\u5728\u8fc7\u53bb\u7684\u51e0\u5341\u5e74\u91cc\uff0c\u91cf\u5b50\u529b\u5b66\u5efa\u6a21\u4ece\u51e0\u4e2a\u539f\u5b50\u7ec4\u6210\u7684\u5355\u4e2a\u539f\u5b50\u53d1\u5c55\u5230\u690d\u5165\u5728\u590d\u6742\u73af\u5883\u4e2d\u7684\u5927\u578b\u8d85\u5206\u5b50\u805a\u96c6\u4f53\u3002\u5728\u591a\u5c3a\u5ea6\u6a21\u578b\u4e2d\u5c06\u91cf\u5b50\u529b\u5b66\u6a21\u578b\u548c\u7ecf\u5178\u63cf\u8ff0\u7ed3\u5408\u8d77\u6765\u6709\u7740\u72ec\u7279\u7684\u4f18\u52bf\u3002\u7b2c\u4e00\u4e2a\u5178\u578b\u4ee3\u8868\u5c31\u662f\u4e8c\u5341\u4e16\u7eaa80\u5e74\u4ee3\u7684\u8fde\u7eed\u6eb6\u89e3\u6a21\u578b\u5e7f\u6cdb\u6210\u529f\u5e94\u7528\u4e8e\u6eb6\u8d28\u5206\u5b50\u3002\u51e0\u4e4e\u540c\u5e74\uff0c\u57fa\u4e8e\u5206\u5b50\u529b\u5b66\u5f97\u7ecf\u5178\u63cf\u8ff0\u548c\u91cf\u5b50\u529b\u5b66\u65b9\u6cd5\u7ed3\u5408\uff0c\u79f0\u4e3a\u6742\u5316QM\/MM\u65b9\u6cd5\u3002\u81ea\u9996\u6b21\u89c4\u8303\u5316\u540e\uff0c\u8fd9\u4e9b\u91cf\u5b50\u529b\u5b66\/\u7ecf\u5178\u6a21\u578b\u5728\u7cbe\u5ea6\u3001\u9c81\u68d2\u6027\u548c\u666e\u904d\u6027\u65b9\u9762\u90fd\u83b7\u5f97\u4e86\u8f83\u5927\u53d1\u5c55\u3002\u8fd9\u4e00\u8fdb\u6b65\u4f7f\u5f97\u6742\u5316\u65b9\u6cd5\u5728\u66f4\u4e3a\u590d\u6742\u548c\u91cf\u5b50\u5316\u5b66\u6b64\u524d\u672a\u66fe\u6d89\u8db3\u7684\u9886\u57df\uff0c\u6bd4\u5982\u5728\u751f\u7269\u5206\u5b50\u3001\u7eb3\u7c73\u6750\u6599\u4ee5\u53ca\u66f4\u4e3a\u666e\u904d\u7684\u590d\u5408\u6750\u6599\u4e2d\u7684\u5149\u9a71\u52a8\u8fc7\u7a0b\u5b9e\u73b0\u4e86\u5e94\u7528\u3002\u8fd9\u51e0\u7c7b\u4f53\u7cfb\u5177\u6709\u5206\u5b50\u3002\u7eb3\u7c73\u548c\u4ecb\u89c2\u7b49\u4e0d\u540c\u7684\u5c3a\u5ea6\uff0c\u9700\u8981\u591a\u5c3a\u5ea6\u65b9\u6cd5\u6765\u5b9e\u73b0\u6574\u4f53\u7684\u7814\u7a76\u3002<\/p>\n<p>\u3010\u6210\u679c\u7b80\u4ecb\u3011<\/p>\n<p>\u8fd1\u65e5\uff0c<strong>\u610f\u5927\u5229\u6bd4\u8428\u5927\u5b66<\/strong>\u7684<strong>Benedetta Mennucci<\/strong><strong>\u6559\u6388<\/strong>\u548c<strong>\u6bd4\u8428\u5927\u5b66<\/strong><strong>\/CNR<\/strong><strong>\u7eb3\u7c73\u79d1\u5b66\u7814\u7a76\u9662<\/strong>\u7684<strong>Stefano Corni<\/strong><strong>\u6559\u6388<\/strong>\u5728\u56fd\u9645\u9876\u7ea7\u671f\u520a<strong>Nature Reviews Chemistry<\/strong>\u4e0a\u53d1\u8868\u4e86\u9898\u4e3a\u201c<strong>Multiscale modelling of photoinduced processes in composite 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preserved simplicity of interpretation combined with an enhanced realism.\uff09<\/p>\n<p>&nbsp;<\/p>\n<p>\u6587\u732e\u94fe\u63a5\uff1a<a href=\"10.1038\/s41570-019-0092-4\" target=\"_blank\" rel=\"noopener\">Multiscale modelling of photoinduced processes in composite systems\uff08Nat. Rev. Chem.\uff0c2019\uff0cDOI\uff1a10.1038\/s41570-019-0092-4\uff09<\/a><\/p>\n<p>\u672c\u6587\u7531Isobel\u7f16\u8f91\u3002<\/p>\n<p>&nbsp;<\/p>\n","protected":false},"excerpt":{"rendered":"<p>\u3010\u5f15\u8a00\u3011 \u5728\u8fc7\u53bb\u7684\u51e0\u5341\u5e74\u91cc\uff0c\u91cf\u5b50\u529b\u5b66\u5efa\u6a21\u4ece\u51e0\u4e2a\u539f\u5b50\u7ec4\u6210\u7684\u5355\u4e2a\u539f\u5b50\u53d1\u5c55\u5230\u690d\u5165\u5728\u590d\u6742\u73af\u5883\u4e2d\u7684\u5927\u578b\u8d85\u5206\u5b50\u805a\u96c6\u4f53\u3002\u5728\u591a\u5c3a\u5ea6\u6a21\u578b\u4e2d\u5c06\u91cf\u5b50\u529b\u5b66\u6a21\u578b\u548c\u7ecf\u5178\u63cf\u8ff0\u7ed3\u5408\u8d77\u6765\u6709\u7740\u72ec\u7279&#8230;<\/p>\n","protected":false},"author":4765,"featured_media":174831,"comment_status":"open","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[2,533],"tags":[4017,4018,3290],"class_list":["post-174830","post","type-post","status-publish","format-standard","has-post-thumbnail","hentry","category-keji","category-zongshu","tag-4017","tag-4018","tag-3290"],"_links":{"self":[{"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts\/174830"}],"collection":[{"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/users\/4765"}],"replies":[{"embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=174830"}],"version-history":[{"count":2,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts\/174830\/revisions"}],"predecessor-version":[{"id":175392,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts\/174830\/revisions\/175392"}],"wp:featuredmedia":[{"embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/media\/174831"}],"wp:attachment":[{"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=174830"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=174830"},{"taxonomy":"post_tag","embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=174830"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}