{"id":14823,"date":"2016-05-22T08:00:17","date_gmt":"2016-05-22T00:00:17","guid":{"rendered":"\/\/m.iemloyee.com\/?p=14823"},"modified":"2016-05-21T21:11:43","modified_gmt":"2016-05-21T13:11:43","slug":"nature-communications%ef%bc%9a%e7%be%8e%e5%9b%bd%e7%a0%94%e7%a9%b6%e4%ba%ba%e5%91%98%e5%bc%80%e5%8f%91%e8%87%aa%e9%80%82%e5%ba%94%e6%80%a7%e6%9c%ba%e5%99%a8%e5%ad%a6%e4%b9%a0%e6%a1%86%e6%9e%b6","status":"publish","type":"post","link":"\/\/m.iemloyee.com\/?p=14823","title":{"rendered":"Nature Communications\uff1a\u7f8e\u79d1\u5b66\u5bb6\u5f00\u53d1\u81ea\u9002\u5e94\u6027\u673a\u5668\u5b66\u4e60\u6846\u67b6\uff0c\u6709\u6548\u52a0\u901f\u65b0\u6750\u6599\u7814\u53d1\u8fdb\u7a0b"},"content":{"rendered":"<p>\u636e\u8fd1\u671fNature 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\u9002\u5e94\u6027\u8bbe\u8ba1<\/b><\/strong><strong><b>\u7684<\/b><\/strong><strong><b>\u73af\u5f62\u56fe<\/b><\/strong><\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-14824\" src=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72471-14.png\" alt=\"\u56fe\u72471\" width=\"592\" height=\"434\" srcset=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72471-14.png 592w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72471-14-300x220.png 300w\" sizes=\"(max-width: 592px) 100vw, 592px\" 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\u793a\u4f8b\u5408\u91d1<\/b><\/strong><strong><b>\u7684<\/b><\/strong><strong><b>\u8bbe\u8ba1<\/b><\/strong><strong><b>\u53ca\u5176<\/b><\/strong><strong><b>\u5b9e\u9a8c\u5faa\u73af\u793a\u610f\u56fe<\/b><\/strong><\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-14825\" src=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72472-7.png\" alt=\"\u56fe\u72472\" width=\"826\" height=\"453\" srcset=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72472-7.png 826w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72472-7-300x165.png 300w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72472-7-768x421.png 768w\" sizes=\"(max-width: 826px) 100vw, 826px\" 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loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-14826\" src=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72473-7.png\" alt=\"\u56fe\u72473\" width=\"584\" height=\"388\" srcset=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72473-7.png 584w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72473-7-300x199.png 300w\" sizes=\"(max-width: 584px) 100vw, 584px\" \/><\/p>\n<p>\u672c\u56fe\u663e\u793a\u4e86\u6709\u5173\u954d\u949b\u5f62\u72b6\u8bb0\u5fc6\u5408\u91d1\u8bad\u7ec3\u6570\u636e\u96c6\u7684\u56de\u5f52\u91cf:\u9009\u62e9\u5668\u7ec4\u5408\uff0c\u4ee5\u53ca\u5404\u4e2a\u56de\u5f52\u91cf:\u9009\u62e9\u5668\u7ec4\u5408\u7684\u76f8\u5bf9\u6027\u80fd\u3002\u6a2a\u5750\u6807\u7ed8\u5236\u4e86\u4ece\u8bad\u7ec3\u96c6\u91cc\u521d\u59cb\u968f\u673a\u9009\u62e9\u7684\u6570\u91cf\uff0c\u4ee5\u6784\u5efa\u7edf\u8ba1\u63a8\u65ad\u6a21\u578b\u3002\u7eb5\u5750\u6807\u662f\u9009\u62e9\u7684\u5e73\u5747\u6570\u91cf\uff0c\u4ee5\u627e\u5230\u8bad\u7ec3\u96c6\u4e2d\u6700\u4f4e\u70ed\u6ede\u540e\u0394T\u7684\u5408\u91d1\u3002\u7ecf\u56de\u5f52\u91cf:\u9009\u62e9\u5668\u7ec4\u5408\u53d1\u73b0\uff0c\u6700\u4f73\u7684\u5408\u91d1\u51fa\u73b0\u5728\u9009\u62e9\u5c3d\u53ef\u80fd\u5c11\u7684\u65f6\u5019\u3002\u56fe\u4e2d\u53ef\u4ee5\u770b\u51fa\uff0c\u5bf9\u4e8e\u954d\u949b\u5f62\u72b6\u8bb0\u5fc6\u5408\u91d1\uff0cSVR<sub>rbf<\/sub>:KG\uff08\u8fde\u7eed\u7ea2\u7ebf\uff09\u662f\u6700\u597d\u7684\u56de\u5f52\u91cf:\u9009\u62e9\u5668\u7ec4\u5408\u3002<\/p>\n<p>\u6ce8\uff1aSVR:Support Vector Regression \u652f\u6301\u5411\u91cf\u56de\u5f52<\/p>\n<p>GPM:Gaussian Process Model \u9ad8\u65af\u8fc7\u7a0b\u52a8\u6001\u6a21\u578b<\/p>\n<p>KG:Knowledge Gradient \u00a0\u77e5\u8bc6\u68af\u5ea6<\/p>\n<p>EGO:Efficient Global Optimization \u9ad8\u6548\u5168\u5c40\u4f18\u5316\u7b97\u6cd5<\/p>\n<p>brf:radial basis function \u5f84\u5411\u57fa\u51fd\u6570<\/p>\n<p>lin: linear kernel \u7ebf\u6027\u6838\u51fd\u6570<\/p>\n<p>Min:minimum \u6700\u5c0f\u503c<\/p>\n<p><strong><b>\u56fe\u4e09<\/b><\/strong><strong><b>\u00a0\u63a8\u7406<\/b><\/strong><strong><b>\u53ca<\/b><\/strong><strong><b>\u5168\u5c40\u4f18\u5316<\/b><\/strong><strong><b>\u7684<\/b><\/strong><strong><b>\u7ed3\u679c<\/b><\/strong><strong><b>\u4e0e\u601d\u8003<\/b><\/strong><\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-14827\" src=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72474-6.png\" alt=\"\u56fe\u72474\" width=\"325\" height=\"516\" srcset=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72474-6.png 325w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72474-6-189x300.png 189w\" sizes=\"(max-width: 325px) 100vw, 325px\" \/><\/p>\n<p>\u56fe3a 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\u70ed\u6ede\u540e\u0394T\u4e0e\u4ef7\u7535\u5b50\u6570\u7684\u51fd\u6570\u66f2\u7ebf\u8bf4\u660e\uff1a\u8fed\u4ee33\u6b21\u540e\uff0c\u5728\u4e00\u4e2a\u72ed\u7a84\u533a\u57df\u5185\u6709\u660e\u663e\u7684\u4f4e\u503c\uff0c\u8fd9\u6709\u5229\u4e8e\u7acb\u65b9\u4f53\u8f6c\u53d8\u4e3a\u659c\u65b9\u516d\u9762\u4f53\uff0c\u4e14\u4e0e\u7acb\u65b9\u4f53\u8f6c\u53d8\u4e3a\u6b63\u4ea4\u6676\u7cfb\u6216\u5355\u659c\u6676\u7cfb\u76f8\u6bd4\uff0c\u8be5\u503c\u4e3a\u5df2\u77e5\u7684\u6700\u5c0f\u0394T(\u5168\u5c40\u6700\u4f4e\u503c)\u3002\u4f8b\u5982\uff0c\u7531\u4e8eSVR<sub>rbf<\/sub>:KG\u578b\u56de\u5f52\u91cf:\u9009\u62e9\u5668\u7ec4\u5408\u63a2\u7d22\u5230\u57286.95\u9644\u8fd1\u7684\u5c40\u90e8\u6700\u5c0f\u503c\uff0c\u6700\u7ec8\u53d1\u73b0\u4e86Ti<sub>50.0<\/sub>Ni<sub>46.7<\/sub>Cu<sub>0.8<\/sub>-Fe<sub>2.3<\/sub>Pd<sub>0.2<\/sub>\u5408\u91d1\u3002\uff08\u63d2\u56fe\u4e3a\u4ef7\u7535\u5b50\u65706.9\u81f37.00\u7684\u533a\u57df\u653e\u5927\u56fe\uff09<\/p>\n<p>\u56fe3c \u5982\u56fe\u6240\u793a\uff0c\u56fe\u4e3a\u56db\u79cd\u5408\u6210\u5408\u91d1\u7684\u5e73\u5747\u4ef7\u7535\u5b50\u6570\u91cf\u4e0e\u8fed\u4ee3\u6570\u7684\u51fd\u6570,\u663e\u793a\u4e86\u5728\u8be5\u7279\u5f81\u7a7a\u95f4\u5185\u81ea\u9002\u5e94\u8bbe\u8ba1\u7684\u63a2\u7d22\u6027\u8d28(\u8fed\u4ee31\u30012\u6b21\u548c7\u6b21\u540e\u7684\u6807\u51c6\u5dee\/\u8bef\u5dee\u7ebf)\u3002\u8bef\u5dee\u7ebf\u8868\u793a\u56db\u4e2a\u6837\u54c1\u7684\u4ef7\u7535\u5b50\u6570\u6807\u51c6\u504f\u5dee\u3002\u7b2c\u5341\u4e2a\u8fed\u4ee3\u8868\u660e\u8bbe\u8ba1\u660e\u663e\u504f\u79bb\u4e86\u5168\u5c40\u6700\u4f4e\u503c( \u5728y\u8f74\u7ea66.96\u5904)\u3002<\/p>\n<p><strong><b>\u56fe\u56db <\/b><\/strong><strong><b>Ti<\/b><\/strong><strong><sub><b>50.0<\/b><\/sub><\/strong><strong><b>Ni<\/b><\/strong><strong><sub><b>46.7<\/b><\/sub><\/strong><strong><b>Cu<\/b><\/strong><strong><sub><b>0.8<\/b><\/sub><\/strong><strong><b>Fe<\/b><\/strong><strong><sub><b>2.3<\/b><\/sub><\/strong><strong><b>Pd<\/b><\/strong><strong><sub><b>0.2<\/b><\/sub><\/strong><strong><b>\u5408\u91d1<\/b><\/strong><strong><b>\u7684\u5b9e\u9a8c\u6d4b\u91cf\u503c<\/b><\/strong><\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-14828\" src=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72475-8.png\" alt=\"\u56fe\u72475\" width=\"861\" height=\"289\" srcset=\"\/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72475-8.png 861w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72475-8-300x101.png 300w, \/\/m.iemloyee.com\/wp-content\/uploads\/2016\/05\/\u56fe\u72475-8-768x258.png 768w\" sizes=\"(max-width: 861px) 100vw, 861px\" \/><\/p>\n<p>\u56fe4a \u56fe\u4e3a\u65b0\u5408\u91d1Ti<sub>50.0<\/sub>Ni<sub>46.7<\/sub>Cu<sub>0.8<\/sub>Fe<sub>2.3<\/sub>Pd<sub>0.2<\/sub>\u7684\u7535\u963b\u7387\u968f\u6e29\u5ea6\u53d8\u5316\u66f2\u7ebf\u3002\u4e0eNiTi\u76f8\u6bd4\uff0c\u65b0\u5408\u91d1\u8868\u73b0\u51fa\u975e\u5e38\u5c0f\u7684\u8fdf\u6ede\u73b0\u8c61\u3002\u63d2\u56fe\u4e3a\u00a0Ni<sub>50<\/sub>Ti<sub>50<\/sub>\u7684\u7535\u963b\u7387\u968f\u6e29\u5ea6\u53d8\u5316\u66f2\u7ebf\u3002<\/p>\n<p>\u56fe4b Ti<sub>50.0<\/sub>Ni<sub>46.7<\/sub>Cu<sub>0.8<\/sub>Fe<sub>2.3<\/sub>Pd<sub>0.2<\/sub>\u7684DSC\u66f2\u7ebf\u4e2d\u4e24\u5438\u6536\u5cf0\u4e4b\u5dee\u0394T\u4e3a1.84 K\uff0c\u8fd9\u662f\u954d\u949b\u5f62\u72b6\u8bb0\u5fc6\u5408\u91d1\u6750\u6599\u6709\u5173\u8bb0\u5f55\u4e2d\u7684\u6700\u4f4e\u503c\u3002\u540c\u65f6\u70ed\u5faa\u73af\u540e(60\u6b21\u52a0\u70ed\u548c\u51b7\u5374\u5faa\u73af)\u4e5f\u53ea\u6709\u975e\u5e38\u5c0f\u7684\u504f\u79fb(\u5982\u63d2\u56fe\u6240\u793a\uff0c\u7ea6\u4e3a0.02 K)\uff0c\u8868\u660e\u4f18\u826f\u7684\u6297\u70ed\u75b2\u52b3\u6027\u80fd\u3002<\/p>\n<p>\u65b0\u95fb\u94fe\u63a5\uff1a<a href=\"http:\/\/phys.org\/news\/2016-05-machine-discovery-materials.html\">Machine learning accelerates the discovery of new materials<\/a><\/p>\n<p>\u6587\u732e\u94fe\u63a5\uff1a<a href=\"http:\/\/www.nature.com\/ncomms\/2016\/160415\/ncomms11241\/full\/ncomms11241.html\">Accelerated search for materials with targeted properties by adaptive design<\/a><\/p>\n<p>\u6750\u6599\u4eba\u7ec4\u5efa\u4e86\u6750\u6599\u4eba\u6750\u6599\u8ba1\u7b97\u4ea4\u6d41QQ\u7fa4\uff0c\u6b22\u8fce\u4ece\u4e8b\u6750\u6599\u8ba1\u7b97\u7684\u6750\u6599\u4eba\u4eec\u52a0\u5165\uff01QQ\u7fa4\u53f7\uff1a562663183\u3002<\/p>\n<p>\u611f\u8c22\u6750\u6599\u4eba\u7f16\u8f91\u90e8\u5c09\u8c37\u96e8\u63d0\u4f9b\u7d20\u6750<\/p>\n","protected":false},"excerpt":{"rendered":"<p>\u636e\u8fd1\u671fNature Communications\u4e0a\u7684\u4e00\u7bc7\u6587\u7ae0\u6240\u8ff0\uff0c\u7f8e\u56fd\u7814\u7a76\u4eba\u5458\u57fa\u4e8e\u4e00\u79cd\u4e0e\u5b9e\u9a8c\u7d27\u5bc6\u8026\u5408\u7684\u4fe1\u606f\u79d1\u5b66\u9002\u5e94\u6027\u8bbe\u8ba1\uff0c\u52a0\u901f\u4e86\u5177\u6709\u76ee\u6807\u6027\u80fd\u65b0\u6750\u6599\u7684\u53d1\u73b0\u8fdb\u7a0b\u3002\u6362&#8230;<\/p>\n","protected":false},"author":86,"featured_media":14824,"comment_status":"open","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[2],"tags":[54,97],"class_list":["post-14823","post","type-post","status-publish","format-standard","has-post-thumbnail","hentry","category-keji","tag-making","tag-computation"],"_links":{"self":[{"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts\/14823"}],"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\/86"}],"replies":[{"embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=14823"}],"version-history":[{"count":7,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts\/14823\/revisions"}],"predecessor-version":[{"id":14971,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/posts\/14823\/revisions\/14971"}],"wp:featuredmedia":[{"embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=\/wp\/v2\/media\/14824"}],"wp:attachment":[{"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=14823"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=14823"},{"taxonomy":"post_tag","embeddable":true,"href":"\/\/m.iemloyee.com\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=14823"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}