{"id":2190,"date":"2024-04-10T13:26:10","date_gmt":"2024-04-10T11:26:10","guid":{"rendered":"http:\/\/10.128.3.28\/?page_id=2190"},"modified":"2025-08-29T12:14:33","modified_gmt":"2025-08-29T10:14:33","slug":"proyecto-simulations-of-carbon-based-electrodes-for-a-new-generation-of-more-efficient-bateries-2","status":"publish","type":"page","link":"https:\/\/computaex.es\/en\/proyectos\/proyecto-simulations-of-carbon-based-electrodes-for-a-new-generation-of-more-efficient-bateries-2\/","title":{"rendered":"Simulations of carbon-based electrodes for a new generation of more efficient bateries"},"content":{"rendered":"<p style=\"text-align: justify;\"><strong>Investigadores:<\/strong><\/p>\n<ul style=\"text-align: justify;\">\n<li>C\u00e9sar Gonz\u00e1lez.\u00a0Universidad Complutense de Madrid [<a href=\"http:\/\/www.ucm.es\/\" target=\"_blank\" rel=\"noopener\" data-cke-saved-href=\"http:\/\/www.ucm.es\/\">UCM<\/a>].<\/li>\n<\/ul>\n<p style=\"text-align: justify;\"><strong>Descripci\u00f3n:<\/strong><\/p>\n<p style=\"text-align: justify;\">Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\" data-cke-saved-href=\"https:\/\/www.res.es\/\">RES<\/a>).<\/p>\n<p style=\"text-align: justify;\">Solid state batteries have recently acquired a great importance due to their advantages respect the other types. Normally, graphite has been chosen as the anode electrode due to the fantastic electronic properties and the low chemical reactivity. Doping the C-based structures with N, an improvement in the electrode performance is obtained. In this project, using precise mechano-quantum calculations based on the Density Functional Theory, we have planned to study graphite and nanotubes doped with different elements (N or B) in order to establish their potential improvement in the electronic interchange as well as the ionic mobility. We will study the inclusion of different types and number of alkaline ions (Li, Na, K) to find the best arrangements and the saturation number. All these parameters will suggest the best future electrode.<\/p>\n","protected":false},"excerpt":{"rendered":"<p>Investigadores: C\u00e9sar Gonz\u00e1lez.\u00a0Universidad Complutense de Madrid [UCM]. Descripci\u00f3n: Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (RES). Solid state batteries have recently acquired a great importance due to &#8230;<\/p>\n","protected":false},"author":1,"featured_media":0,"parent":9950,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"categories":[102,103,81],"tags":[],"class_list":["post-2190","page","type-page","status-publish","hentry","category-ciencias-de-la-tierra","category-ciencias-de-la-vida","category-proyectos"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.6 - https:\/\/yoast.com\/product\/yoast-seo-wordpress\/ -->\n<title>Simulations of carbon-based electrodes for a new generation of more efficient bateries - Fundaci\u00f3n COMPUTAEX<\/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:\/\/computaex.es\/en\/proyectos\/proyecto-simulations-of-carbon-based-electrodes-for-a-new-generation-of-more-efficient-bateries-2\/\" \/>\n<meta property=\"og:locale\" content=\"en_US\" \/>\n<meta property=\"og:type\" content=\"article\" \/>\n<meta property=\"og:title\" content=\"Simulations of carbon-based electrodes for a new generation of more efficient bateries - Fundaci\u00f3n COMPUTAEX\" \/>\n<meta property=\"og:description\" content=\"Investigadores: C\u00e9sar Gonz\u00e1lez.\u00a0Universidad Complutense de Madrid [UCM]. Descripci\u00f3n: Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (RES). 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