{"id":17,"date":"2022-12-02T15:05:36","date_gmt":"2022-12-02T15:05:36","guid":{"rendered":"https:\/\/sites.ohio.edu\/drabold\/?page_id=17"},"modified":"2022-12-02T15:39:38","modified_gmt":"2022-12-02T15:39:38","slug":"carbon-graphitization","status":"publish","type":"page","link":"https:\/\/sites.ohio.edu\/drabold\/carbon-graphitization\/","title":{"rendered":"Carbon graphitization processes: the movies!"},"content":{"rendered":"\n<p class=\"has-foreground-color has-text-color\">Chinonso Ugwumadu, Rajendra Thapa and <a href=\"http:\/\/daviddrabold.com\" data-type=\"URL\" data-id=\"daviddrabold.com\">D. A. Drabold<\/a>, Ohio University<\/p>\n\n\n\n<p>In these links, we offer highly realistic animations of layering transitions in carbon materials. These simulations are all carried out at 3000K, at densities near that of graphite. The simulations mostly employed the remarkable ML GAP potential of Volker Deringer and G\u00e1bor Cs\u00e1nyi [<a href=\"https:\/\/journals.aps.org\/prb\/abstract\/10.1103\/PhysRevB.95.094203\" data-type=\"URL\" data-id=\"https:\/\/journals.aps.org\/prb\/abstract\/10.1103\/PhysRevB.95.094203\">Phys. Rev. B <strong>95<\/strong>, 094203 (2017)<\/a>]. <\/p>\n\n\n\n<p>Bulk solid: &#8220;<a rel=\"noreferrer noopener\" href=\"https:\/\/people.ohio.edu\/drabold\/pubs\/246.pdf\" data-type=\"URL\" data-id=\"https:\/\/people.ohio.edu\/drabold\/pubs\/246.pdf\" target=\"_blank\">Amorphous Graphite<\/a>&#8221; [<a href=\"https:\/\/youtu.be\/XoM5ZeWf3OQ\" data-type=\"URL\" data-id=\"https:\/\/youtu.be\/XoM5ZeWf3OQ\">Simulation of 1000 atoms at density 2.44 gm\/cc and random initial coordinates<\/a>]. See also <a href=\"https:\/\/people.ohio.edu\/drabold\/pubs\/250.pdf\" data-type=\"URL\" data-id=\"https:\/\/people.ohio.edu\/drabold\/pubs\/250.pdf\">this reference<\/a>.<\/p>\n\n\n\n<p><a href=\"https:\/\/people.ohio.edu\/drabold\/pubs\/249.pdf\" data-type=\"URL\" data-id=\"https:\/\/people.ohio.edu\/drabold\/pubs\/249.pdf\">Multi-shell fullerenes &#8220;buckyonions&#8221;<\/a> [<a href=\"https:\/\/people.ohio.edu\/drabold\/cepa_movies\/BO%20growthProcess.mp4\" data-type=\"URL\" data-id=\"https:\/\/people.ohio.edu\/drabold\/cepa_movies\/BO%20growthProcess.mp4\">Simulation of shell formation<\/a>]<\/p>\n\n\n\n<p><a href=\"https:\/\/people.ohio.edu\/drabold\/pubs\/251.pdf\" data-type=\"URL\" data-id=\"https:\/\/people.ohio.edu\/drabold\/pubs\/251.pdf\">Multi-wall nanotubes<\/a> [<a href=\"https:\/\/people.ohio.edu\/drabold\/nanotubes\/Hollow_CNT_mov.mp4\" data-type=\"URL\" data-id=\"https:\/\/people.ohio.edu\/drabold\/nanotubes\/Hollow_CNT_mov.mp4\">Simulation of a hollow CNT<\/a>]<\/p>\n","protected":false},"excerpt":{"rendered":"<p>Chinonso Ugwumadu, Rajendra Thapa and D. A. Drabold, Ohio University In these links, we offer highly realistic animations of layering transitions in carbon materials. These simulations are all carried out at 3000K, at densities near that of graphite. The simulations mostly employed the remarkable ML GAP potential of Volker Deringer and G\u00e1bor Cs\u00e1nyi [Phys. Rev. [&hellip;]<\/p>\n","protected":false},"author":2,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"class_list":["post-17","page","type-page","status-publish","hentry"],"_links":{"self":[{"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/pages\/17","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/users\/2"}],"replies":[{"embeddable":true,"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/comments?post=17"}],"version-history":[{"count":2,"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/pages\/17\/revisions"}],"predecessor-version":[{"id":20,"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/pages\/17\/revisions\/20"}],"wp:attachment":[{"href":"https:\/\/sites.ohio.edu\/drabold\/wp-json\/wp\/v2\/media?parent=17"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}