{"id":640,"date":"2021-06-27T09:43:54","date_gmt":"2021-06-27T09:43:54","guid":{"rendered":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/?post_type=tribe_events&#038;p=640"},"modified":"2021-08-04T12:54:59","modified_gmt":"2021-08-04T12:54:59","slug":"session-5","status":"publish","type":"tribe_events","link":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/","title":{"rendered":"Session #5"},"content":{"rendered":"<p><em>The weekly seminar is held on Zoom every Tuesday at 7am\u201311am PST, 10am\u20132pm EST, 4pm\u20138pm CET, 0pm-4am AEST. For each invited research group, the presentation consists of a 30-minutes talk or two 15-minutes talks, allowing students to present some recent work on DFT and\/or TDDFT theory development. Each talk is preceded by a brief introduction of the presenter and followed by 10 minutes for discussion.<\/em><\/p>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">10:00-10:10<\/p>\n<p style=\"margin: 0 0 60 0;padding: 0 0 60 0\"><strong>Introduction<\/strong><\/p>\n<ul>\n<li style=\"margin: 0;padding: 0\">Chair: Thomas E. Baker (<a href=\"https:\/\/www.york.ac.uk\/physics\/\">University of York<\/a>)<\/li>\n<\/ul>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">10:10-10:50<\/p>\n<p style=\"margin: 0;padding: 0\"><strong>DFT Surrogate modeling with the Materials Learning Algorithms (MALA) &#8211; Theoretical Background<\/strong><\/p>\n<ul>\n<li style=\"margin: 0;padding: 0\">Presenter: Lenz Fiedler (<a href=\"https:\/\/www.casus.science\/research\/matter-under-extreme-conditions\/\">Helmholtz-Zentrum Dresden-Rossendorf<\/a>)<\/li>\n<li style=\"margin: 0;padding: 0\">Introduction by: Timothy James Callow (<a href=\"https:\/\/www.casus.science\/research\/matter-under-extreme-conditions\/\">Helmholtz-Zentrum Dresden-Rossendorf<\/a>)<\/li>\n<li>Supervisor: Attila Cangi\u00a0(<a href=\"https:\/\/www.casus.science\/research\/matter-under-extreme-conditions\/\">Helmholtz-Zentrum Dresden-Rossendorf<\/a>)<\/li>\n<\/ul>\n<p><a class=\"btn btn\" href=\"https:\/\/www.youtube.com\/watch?v=2416r1JWDWA\" target=\"_blank\" rel=\"noopener\">Watch the Video<\/a><\/p>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">10:50-11:30<\/p>\n<p style=\"margin: 0;padding: 0\"><strong>Machine learning the derivative discontinuity of density-functional theory<\/strong><\/p>\n<ul>\n<li style=\"margin: 0;padding: 0\">Presenter: Johannes Gedeon (<a href=\"https:\/\/www.tddft.org\/bmg\/\">Martin-Luther-Universit\u00e4t Halle-Wittenberg<\/a>)<\/li>\n<li style=\"margin: 0;padding: 0\">Introduction by: Miguel Marques (<a href=\"https:\/\/www.tddft.org\/bmg\/\">Martin-Luther-Universit\u00e4t Halle-Wittenberg<\/a>)<\/li>\n<li>Supervisor:\u00a0Miguel Marques (<a href=\"https:\/\/www.tddft.org\/bmg\/\">Martin-Luther-Universit\u00e4t Halle-Wittenberg<\/a>)<\/li>\n<\/ul>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">11:30-11:50<\/p>\n<p style=\"margin: 0 0 60 0;padding: 0 0 60 0\"><strong>Break<\/strong><\/p>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">11:50-12:30<\/p>\n<p style=\"margin: 0;padding: 0\"><strong>Constrained Machine Learning de-orbitalization of meta-GGA exchange-correlation functionals<\/strong><\/p>\n<ul>\n<li style=\"margin: 0;padding: 0\">Presenter: Kanun Pokharel (<a href=\"https:\/\/sse.tulane.edu\/pep\">Tulane University<\/a>)<\/li>\n<li style=\"margin: 0;padding: 0\">Introduction by: James Furness (<a href=\"https:\/\/sse.tulane.edu\/pep\">Tulane University<\/a>)<\/li>\n<li>Supervisor: Jianwei Sun (<a href=\"https:\/\/sse.tulane.edu\/pep\">Tulane University<\/a>)<\/li>\n<\/ul>\n<p><a class=\"btn btn\" href=\"https:\/\/www.youtube.com\/watch?v=0nE5tq0xiHQ\" target=\"_blank\" rel=\"noopener\">Watch the Video<\/a><\/p>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">12:30-13:10<\/p>\n<p style=\"margin: 0;padding: 0\"><strong>Machine learning density functionals: Testing the Kohn-Sham regularizer for strongly and weakly correlated systems<\/strong><\/p>\n<ul>\n<li style=\"margin: 0;padding: 0\">Presenter: Bhupalee Kalita (<a href=\"https:\/\/dft.uci.edu\/\">University of California, Irvine<\/a>)<\/li>\n<li style=\"margin: 0;padding: 0\">Introduction by: Ryan J. McCarty (<a href=\"https:\/\/dft.uci.edu\/\">University of California, Irvine<\/a>)<\/li>\n<li>Supervisor: Kieron Burke (<a href=\"https:\/\/dft.uci.edu\/\">University of California, Irvine<\/a>)<\/li>\n<\/ul>\n<hr \/>\n<p style=\"margin: 0;padding: 0\">13:10-13:50<\/p>\n<p style=\"margin: 0;padding: 0\"><b>Statistical learning of electron dynamics in molecular systems<\/b><\/p>\n<ul>\n<li style=\"margin: 0;padding: 0\">Presenter: Karnamohit Ranka (<a href=\"https:\/\/sites.ucmerced.edu\/cisborn\">University of California, Merced<\/a>)<\/li>\n<li style=\"margin: 0;padding: 0\">Introduction by: Sapana Soni (<a href=\"https:\/\/sites.ucmerced.edu\/cisborn\">University of California, Merced<\/a>)<\/li>\n<li>Supervisor: Christine Isborn (<a href=\"https:\/\/sites.ucmerced.edu\/cisborn\">University of California, Merced<\/a>)<\/li>\n<\/ul>\n<p><a class=\"btn btn\" href=\"https:\/\/www.youtube.com\/watch?v=j7mY_2K8h1Y\" target=\"_blank\" rel=\"noopener\">Watch the Video<\/a><\/p>\n","protected":false},"excerpt":{"rendered":"<p>The weekly seminar is held on Zoom every Tuesday at 7am\u201311am PST, 10am\u20132pm EST, 4pm\u20138pm CET, 0pm-4am AEST. For each invited research group, the presentation consists of a 30-minutes talk &hellip; <a href=\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/\" class=\"\">Read More<\/a><\/p>\n","protected":false},"author":1708,"featured_media":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"_acf_changed":false,"_tribe_events_status":"","_tribe_events_status_reason":"","footnotes":""},"tags":[],"tribe_events_cat":[8],"class_list":["post-640","tribe_events","type-tribe_events","status-publish","hentry","tribe_events_cat-public-events","cat_public-events"],"acf":[],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v23.5 - https:\/\/yoast.com\/wordpress\/plugins\/seo\/ -->\n<title>Session #5 - (TD)DFT Student Seminar Series<\/title>\n<meta name=\"robots\" content=\"index, follow, max-snippet:-1, max-image-preview:large, max-video-preview:-1\" \/>\n<link rel=\"canonical\" href=\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/\" \/>\n<meta property=\"og:locale\" content=\"en_US\" \/>\n<meta property=\"og:type\" content=\"article\" \/>\n<meta property=\"og:title\" content=\"Session #5 - (TD)DFT Student Seminar Series\" \/>\n<meta property=\"og:description\" content=\"The weekly seminar is held on Zoom every Tuesday at 7am\u201311am PST, 10am\u20132pm EST, 4pm\u20138pm CET, 0pm-4am AEST. For each invited research group, the presentation consists of a 30-minutes talk &hellip; Read More\" \/>\n<meta property=\"og:url\" content=\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/\" \/>\n<meta property=\"og:site_name\" content=\"(TD)DFT Student Seminar Series\" \/>\n<meta property=\"article:modified_time\" content=\"2021-08-04T12:54:59+00:00\" \/>\n<meta name=\"twitter:card\" content=\"summary_large_image\" \/>\n<meta name=\"twitter:label1\" content=\"Est. reading time\" \/>\n\t<meta name=\"twitter:data1\" content=\"1 minute\" \/>\n<script type=\"application\/ld+json\" class=\"yoast-schema-graph\">{\"@context\":\"https:\/\/schema.org\",\"@graph\":[{\"@type\":\"WebPage\",\"@id\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/\",\"url\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/\",\"name\":\"Session #5 - (TD)DFT Student Seminar Series\",\"isPartOf\":{\"@id\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/#website\"},\"datePublished\":\"2021-06-27T09:43:54+00:00\",\"dateModified\":\"2021-08-04T12:54:59+00:00\",\"breadcrumb\":{\"@id\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/#breadcrumb\"},\"inLanguage\":\"en-US\",\"potentialAction\":[{\"@type\":\"ReadAction\",\"target\":[\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/\"]}]},{\"@type\":\"BreadcrumbList\",\"@id\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/#breadcrumb\",\"itemListElement\":[{\"@type\":\"ListItem\",\"position\":1,\"name\":\"Home\",\"item\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/\"},{\"@type\":\"ListItem\",\"position\":2,\"name\":\"Events\",\"item\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/events\/\"},{\"@type\":\"ListItem\",\"position\":3,\"name\":\"Session #5\"}]},{\"@type\":\"WebSite\",\"@id\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/#website\",\"url\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/\",\"name\":\"(TD)DFT Student Seminar Series\",\"description\":\"\",\"potentialAction\":[{\"@type\":\"SearchAction\",\"target\":{\"@type\":\"EntryPoint\",\"urlTemplate\":\"https:\/\/sites.rutgers.edu\/dft-student-seminar\/?s={search_term_string}\"},\"query-input\":{\"@type\":\"PropertyValueSpecification\",\"valueRequired\":true,\"valueName\":\"search_term_string\"}}],\"inLanguage\":\"en-US\"}]}<\/script>\n<!-- \/ Yoast SEO plugin. -->","yoast_head_json":{"title":"Session #5 - (TD)DFT Student Seminar Series","robots":{"index":"index","follow":"follow","max-snippet":"max-snippet:-1","max-image-preview":"max-image-preview:large","max-video-preview":"max-video-preview:-1"},"canonical":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/","og_locale":"en_US","og_type":"article","og_title":"Session #5 - (TD)DFT Student Seminar Series","og_description":"The weekly seminar is held on Zoom every Tuesday at 7am\u201311am PST, 10am\u20132pm EST, 4pm\u20138pm CET, 0pm-4am AEST. For each invited research group, the presentation consists of a 30-minutes talk &hellip; Read More","og_url":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/","og_site_name":"(TD)DFT Student Seminar Series","article_modified_time":"2021-08-04T12:54:59+00:00","twitter_card":"summary_large_image","twitter_misc":{"Est. reading time":"1 minute"},"schema":{"@context":"https:\/\/schema.org","@graph":[{"@type":"WebPage","@id":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/","url":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/","name":"Session #5 - (TD)DFT Student Seminar Series","isPartOf":{"@id":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/#website"},"datePublished":"2021-06-27T09:43:54+00:00","dateModified":"2021-08-04T12:54:59+00:00","breadcrumb":{"@id":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/#breadcrumb"},"inLanguage":"en-US","potentialAction":[{"@type":"ReadAction","target":["https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/"]}]},{"@type":"BreadcrumbList","@id":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/event\/session-5\/#breadcrumb","itemListElement":[{"@type":"ListItem","position":1,"name":"Home","item":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/"},{"@type":"ListItem","position":2,"name":"Events","item":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/events\/"},{"@type":"ListItem","position":3,"name":"Session #5"}]},{"@type":"WebSite","@id":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/#website","url":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/","name":"(TD)DFT Student Seminar Series","description":"","potentialAction":[{"@type":"SearchAction","target":{"@type":"EntryPoint","urlTemplate":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/?s={search_term_string}"},"query-input":{"@type":"PropertyValueSpecification","valueRequired":true,"valueName":"search_term_string"}}],"inLanguage":"en-US"}]}},"_links":{"self":[{"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/tribe_events\/640"}],"collection":[{"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/tribe_events"}],"about":[{"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/types\/tribe_events"}],"author":[{"embeddable":true,"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/users\/1708"}],"replies":[{"embeddable":true,"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/comments?post=640"}],"version-history":[{"count":7,"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/tribe_events\/640\/revisions"}],"predecessor-version":[{"id":886,"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/tribe_events\/640\/revisions\/886"}],"wp:attachment":[{"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/media?parent=640"}],"wp:term":[{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/tags?post=640"},{"taxonomy":"tribe_events_cat","embeddable":true,"href":"https:\/\/sites.rutgers.edu\/dft-student-seminar\/wp-json\/wp\/v2\/tribe_events_cat?post=640"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}