{"id":117,"date":"2018-03-02T18:58:29","date_gmt":"2018-03-02T18:58:29","guid":{"rendered":"https:\/\/blogs.ncl.ac.uk\/danielcole\/?p=117"},"modified":"2018-03-02T18:58:29","modified_gmt":"2018-03-02T18:58:29","slug":"dftu","status":"publish","type":"post","link":"https:\/\/blogs.ncl.ac.uk\/danielcole\/2018\/03\/02\/dftu\/","title":{"rendered":"DFT+U"},"content":{"rendered":"<p>Our new pre-print is available on the arXiv: <a href=\"https:\/\/arxiv.org\/abs\/1802.09048\">The role of spin in the calculation of Hubbard <span id=\"MathJax-Element-1-Frame\" class=\"MathJax\"><span id=\"MathJax-Span-1\" class=\"math\"><span id=\"MathJax-Span-2\" class=\"mrow\"><span id=\"MathJax-Span-3\" class=\"mi\">U<\/span><\/span><\/span><\/span> and Hund&#8217;s <span id=\"MathJax-Element-2-Frame\" class=\"MathJax\"><span id=\"MathJax-Span-4\" class=\"math\"><span id=\"MathJax-Span-5\" class=\"mrow\"><span id=\"MathJax-Span-6\" class=\"mi\">J<\/span><\/span><\/span><\/span> parameters from first principles<\/a>.<\/p>\n","protected":false},"excerpt":{"rendered":"<p>Our new pre-print is available on the arXiv: The role of spin in the calculation of Hubbard U and Hund&#8217;s J parameters from first principles.<\/p>\n","protected":false},"author":4424,"featured_media":0,"comment_status":"closed","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[1],"tags":[],"class_list":["post-117","post","type-post","status-publish","format-standard","hentry","category-uncategorised"],"_links":{"self":[{"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/posts\/117","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/users\/4424"}],"replies":[{"embeddable":true,"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/comments?post=117"}],"version-history":[{"count":1,"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/posts\/117\/revisions"}],"predecessor-version":[{"id":118,"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/posts\/117\/revisions\/118"}],"wp:attachment":[{"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/media?parent=117"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/categories?post=117"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/blogs.ncl.ac.uk\/danielcole\/wp-json\/wp\/v2\/tags?post=117"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}