{"id":161,"date":"2020-06-07T17:37:15","date_gmt":"2020-06-07T08:37:15","guid":{"rendered":"http:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/?p=161"},"modified":"2026-03-30T10:05:09","modified_gmt":"2026-03-30T01:05:09","slug":"dc-dftb-md-mtd%e3%81%ae%e9%9a%8e%e5%b1%a4%e7%9a%84%e4%b8%a6%e5%88%97%e5%8c%96%e3%81%ae%e8%ab%96%e6%96%87%e3%81%8c-j-comput-chem-%e3%81%ae%e3%82%ab%e3%83%90%e3%83%bc%e3%82%a4%e3%83%a1%e3%83%bc","status":"publish","type":"post","link":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/?p=161","title":{"rendered":"DC-DFTB-MD\/MTD\u306e\u968e\u5c64\u7684\u4e26\u5217\u5316\u306e\u8ad6\u6587\u304c J. Comput. Chem.\u306e\u30ab\u30d0\u30fc\u30a4\u30e1\u30fc\u30b8\u306b\u63a1\u7528\u3055\u308c\u307e\u3057\u305f"},"content":{"rendered":"<p>DC-DFTB-MD\/MTD\u306e\u968e\u5c64\u7684\u4e26\u5217\u5316\u306e\u8ad6\u6587\u304c J. Comput. Chem.\u306e<a href=\"https:\/\/onlinelibrary.wiley.com\/doi\/10.1002\/jcc.25947\" target=\"_blank\" rel=\"noopener noreferrer\">\u30ab\u30d0\u30fc\u30a4\u30e1\u30fc\u30b8<\/a>\u306b\u63a1\u7528\u3055\u308c\u307e\u3057\u305f\u3002<\/p>\n<p><a href=\"https:\/\/doi.org\/10.1002\/jcc.26217\" target=\"_blank\" rel=\"noopener noreferrer\">\u201cHierarchical parallelization of divide-and-conquer density functional tight-binding molecular dynamics and metadynamics simulations\u201d<\/a><br \/>\nY. Nishimura, H. Nakai,<i>\u00a0J. Comput. Chem.<\/i>,\u00a0<b>41<\/b>, 1759-1772 (2020).<\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"size-full wp-image-165 aligncenter\" src=\"http:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/wp-content\/uploads\/2020\/06\/JCC41_JournalCover-228x300-1.jpg\" alt=\"\" width=\"228\" height=\"300\" \/><\/p>\n<p>&nbsp;<\/p>\n<p>&nbsp;<\/p>\n","protected":false},"excerpt":{"rendered":"<p>DC-DFTB-MD\/MTD\u306e\u968e\u5c64\u7684\u4e26\u5217\u5316\u306e\u8ad6\u6587\u304c J. Comput. Chem.\u306e\u30ab\u30d0\u30fc\u30a4\u30e1\u30fc\u30b8\u306b\u63a1\u7528\u3055\u308c\u307e\u3057\u305f\u3002 \u201cHierarchical parallelization of divide-and-conque &hellip; <a href=\"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/?p=161\" class=\"more-link\"><span class=\"screen-reader-text\">&#8220;DC-DFTB-MD\/MTD\u306e\u968e\u5c64\u7684\u4e26\u5217\u5316\u306e\u8ad6\u6587\u304c J. Comput. Chem.\u306e\u30ab\u30d0\u30fc\u30a4\u30e1\u30fc\u30b8\u306b\u63a1\u7528\u3055\u308c\u307e\u3057\u305f&#8221; \u306e<\/span>\u7d9a\u304d\u3092\u8aad\u3080<\/a><\/p>\n","protected":false},"author":1,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"_locale":"ja","_original_post":"http:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/?p=161","footnotes":""},"categories":[1],"tags":[],"class_list":["post-161","post","type-post","status-publish","format-standard","hentry","category-uncategorized","ja"],"jetpack_featured_media_url":"","_links":{"self":[{"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=\/wp\/v2\/posts\/161","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=161"}],"version-history":[{"count":2,"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=\/wp\/v2\/posts\/161\/revisions"}],"predecessor-version":[{"id":166,"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=\/wp\/v2\/posts\/161\/revisions\/166"}],"wp:attachment":[{"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=161"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=161"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/www.chem.waseda.ac.jp\/dcdftbmd\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=161"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}