{"id":1172,"date":"2025-11-17T14:29:17","date_gmt":"2025-11-17T13:29:17","guid":{"rendered":"https:\/\/www.rfb-predictor.eu\/?page_id=1172"},"modified":"2026-01-29T10:20:17","modified_gmt":"2026-01-29T09:20:17","slug":"dc4_dtu","status":"publish","type":"page","link":"https:\/\/www.rfb-predictor.eu\/?page_id=1172","title":{"rendered":"DC04_DTU"},"content":{"rendered":"\t\t<div data-elementor-type=\"wp-page\" data-elementor-id=\"1172\" class=\"elementor elementor-1172\" data-elementor-post-type=\"page\">\n\t\t\t\t<div class=\"elementor-element elementor-element-3e260b3 e-con-full e-flex elementor-invisible e-con e-parent\" data-id=\"3e260b3\" data-element_type=\"container\" data-e-type=\"container\" data-settings=\"{&quot;background_background&quot;:&quot;classic&quot;,&quot;sticky&quot;:&quot;top&quot;,&quot;sticky_parent&quot;:&quot;yes&quot;,&quot;animation&quot;:&quot;fadeIn&quot;,&quot;sticky_on&quot;:[&quot;desktop&quot;,&quot;tablet&quot;,&quot;mobile&quot;],&quot;sticky_offset&quot;:0,&quot;sticky_effects_offset&quot;:0,&quot;sticky_anchor_link_offset&quot;:0}\">\n\t\t\t\t<div class=\"elementor-element elementor-element-3a925eb elementor-nav-menu__align-center elementor-nav-menu--dropdown-tablet elementor-nav-menu__text-align-aside elementor-nav-menu--toggle elementor-nav-menu--burger elementor-widget elementor-widget-nav-menu\" data-id=\"3a925eb\" data-element_type=\"widget\" data-e-type=\"widget\" data-settings=\"{&quot;layout&quot;:&quot;horizontal&quot;,&quot;submenu_icon&quot;:{&quot;value&quot;:&quot;&lt;svg aria-hidden=\\&quot;true\\&quot; 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Materials BV<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-152\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=76\" class=\"elementor-sub-item\">University of Aalto<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-150\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=81\" class=\"elementor-sub-item\">National Centre for Scientific Research (CNRS)<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-149\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=86\" class=\"elementor-sub-item\">Karlsruhe Institute of Technology<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-147\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=91\" class=\"elementor-sub-item\">CellCube Energy Storage GmbH (ENX)<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-323\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=258\" class=\"elementor-sub-item\">Zurich University of Applied Sciences (ZHAW) &#8211; associated partner<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-407\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=391\" class=\"elementor-sub-item\">Department of Chemical Engineering and Biotechnology, University of Cambridge<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-406\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=396\" class=\"elementor-sub-item\">Accelerated Materials LTD &#8211; associated partner<\/a><\/li>\n<\/ul>\n<\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-431\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=41\" class=\"elementor-item\">DOCTORAL CANDIDATES<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-143\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=56\" class=\"elementor-item\">PUBLICATIONS<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-146\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=46\" class=\"elementor-item\">NEWS<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-153\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=51\" class=\"elementor-item\">EVENTS<\/a><\/li>\n<\/ul>\t\t\t<\/nav>\n\t\t\t\t\t<div class=\"elementor-menu-toggle\" role=\"button\" tabindex=\"0\" aria-label=\"Menu Toggle\" aria-expanded=\"false\">\n\t\t\t<svg aria-hidden=\"true\" role=\"presentation\" class=\"elementor-menu-toggle__icon--open e-font-icon-svg e-eicon-menu-bar\" viewBox=\"0 0 1000 1000\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M104 333H896C929 333 958 304 958 271S929 208 896 208H104C71 208 42 237 42 271S71 333 104 333ZM104 583H896C929 583 958 554 958 521S929 458 896 458H104C71 458 42 487 42 521S71 583 104 583ZM104 833H896C929 833 958 804 958 771S929 708 896 708H104C71 708 42 737 42 771S71 833 104 833Z\"><\/path><\/svg><svg aria-hidden=\"true\" role=\"presentation\" class=\"elementor-menu-toggle__icon--close e-font-icon-svg e-eicon-close\" viewBox=\"0 0 1000 1000\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M742 167L500 408 258 167C246 154 233 150 217 150 196 150 179 158 167 167 154 179 150 196 150 212 150 229 154 242 171 254L408 500 167 742C138 771 138 800 167 829 196 858 225 858 254 829L496 587 738 829C750 842 767 846 783 846 800 846 817 842 829 829 842 817 846 804 846 783 846 767 842 750 829 737L588 500 833 258C863 229 863 200 833 171 804 137 775 137 742 167Z\"><\/path><\/svg>\t\t<\/div>\n\t\t\t\t\t<nav class=\"elementor-nav-menu--dropdown elementor-nav-menu__container\" aria-hidden=\"true\">\n\t\t\t\t<ul id=\"menu-2-3a925eb\" class=\"elementor-nav-menu\"><li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-home menu-item-485\"><a href=\"https:\/\/www.rfb-predictor.eu\/\" class=\"elementor-item\" tabindex=\"-1\">HOME<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-144\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=12\" class=\"elementor-item\" tabindex=\"-1\">RESEARCH<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-145\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=35\" class=\"elementor-item\" tabindex=\"-1\">TRAINING<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-has-children menu-item-141\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=30\" class=\"elementor-item\" tabindex=\"-1\">PARTNERS<\/a>\n<ul class=\"sub-menu elementor-nav-menu--dropdown\">\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-148\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=61\" class=\"elementor-sub-item\" tabindex=\"-1\">Fraunhofer ICT<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-558\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=266\" class=\"elementor-sub-item\" tabindex=\"-1\">Fraunhofer SCAI<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-151\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=66\" class=\"elementor-sub-item\" tabindex=\"-1\">Technical University of Denmark<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-249\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=71\" class=\"elementor-sub-item\" tabindex=\"-1\">Software for Chemistry &#038; Materials BV<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-152\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=76\" class=\"elementor-sub-item\" tabindex=\"-1\">University of Aalto<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-150\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=81\" class=\"elementor-sub-item\" tabindex=\"-1\">National Centre for Scientific Research (CNRS)<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-149\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=86\" class=\"elementor-sub-item\" tabindex=\"-1\">Karlsruhe Institute of Technology<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-147\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=91\" class=\"elementor-sub-item\" tabindex=\"-1\">CellCube Energy Storage GmbH (ENX)<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-323\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=258\" class=\"elementor-sub-item\" tabindex=\"-1\">Zurich University of Applied Sciences (ZHAW) &#8211; associated partner<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-407\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=391\" class=\"elementor-sub-item\" tabindex=\"-1\">Department of Chemical Engineering and Biotechnology, University of Cambridge<\/a><\/li>\n\t<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-406\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=396\" class=\"elementor-sub-item\" tabindex=\"-1\">Accelerated Materials LTD &#8211; associated partner<\/a><\/li>\n<\/ul>\n<\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-431\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=41\" class=\"elementor-item\" tabindex=\"-1\">DOCTORAL CANDIDATES<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-143\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=56\" class=\"elementor-item\" tabindex=\"-1\">PUBLICATIONS<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-146\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=46\" class=\"elementor-item\" tabindex=\"-1\">NEWS<\/a><\/li>\n<li class=\"menu-item menu-item-type-post_type menu-item-object-page menu-item-153\"><a href=\"https:\/\/www.rfb-predictor.eu\/?page_id=51\" class=\"elementor-item\" tabindex=\"-1\">EVENTS<\/a><\/li>\n<\/ul>\t\t\t<\/nav>\n\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-67172e9 e-flex e-con-boxed e-con e-parent\" data-id=\"67172e9\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-47ba1e6 elementor-widget elementor-widget-spacer\" data-id=\"47ba1e6\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"spacer.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t<div class=\"elementor-spacer\">\n\t\t\t<div class=\"elementor-spacer-inner\"><\/div>\n\t\t<\/div>\n\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-05d850f e-con-full e-flex e-con e-parent\" data-id=\"05d850f\" data-element_type=\"container\" data-e-type=\"container\" data-settings=\"{&quot;background_background&quot;:&quot;classic&quot;}\">\n\t\t<div class=\"elementor-element elementor-element-dc24b5c e-con-full animated-slow e-flex elementor-invisible e-con e-child\" data-id=\"dc24b5c\" data-element_type=\"container\" data-e-type=\"container\" data-settings=\"{&quot;animation&quot;:&quot;fadeIn&quot;}\">\n\t\t\t\t<div class=\"elementor-element elementor-element-fa026a4 elementor-widget__width-inherit animated-slow elementor-invisible elementor-widget elementor-widget-testimonial\" data-id=\"fa026a4\" data-element_type=\"widget\" data-e-type=\"widget\" data-settings=\"{&quot;_animation&quot;:&quot;fadeIn&quot;,&quot;_animation_delay&quot;:200}\" data-widget_type=\"testimonial.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t<div class=\"elementor-testimonial-wrapper\">\n\t\t\t\t\t\t\t<div class=\"elementor-testimonial-content\">\u201cI really enjoy contributing to this project from a computational perspective, and I hope that the technology we aim to create can pave the way \nfor the exploration of tons of new organics to be used in ORFBs. What is most exciting for me is the opportunity to discuss and collaborate \nwith people who have the same ultimate goal but approach it from different perspectives.\u201d<\/div>\n\t\t\t\n\t\t\t\t\t\t<div class=\"elementor-testimonial-meta elementor-has-image elementor-testimonial-image-position-aside\">\n\t\t\t\t<div class=\"elementor-testimonial-meta-inner\">\n\t\t\t\t\t\t\t\t\t\t\t<div class=\"elementor-testimonial-image\">\n\t\t\t\t\t\t\t<img fetchpriority=\"high\" decoding=\"async\" width=\"300\" height=\"300\" src=\"https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa-300x300.jpg\" class=\"attachment-medium size-medium wp-image-1179\" alt=\"\" srcset=\"https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa-300x300.jpg 300w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa-1024x1024.jpg 1024w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa-150x150.jpg 150w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa-768x768.jpg 768w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa-1536x1536.jpg 1536w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/elementor\/thumbs\/DC4-DTU-Antonio-Sessa-reuap8k13zs7c6yqtto1f8k3v88aorrnfay2eq5ec0.jpg 200w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2025\/11\/DC4-DTU-Antonio-Sessa.jpg 1736w\" sizes=\"(max-width: 300px) 100vw, 300px\" \/>\t\t\t\t\t\t<\/div>\n\t\t\t\t\t\n\t\t\t\t\t\t\t\t\t\t<div class=\"elementor-testimonial-details\">\n\t\t\t\t\t\t\t\t\t\t\t\t\t\t<div class=\"elementor-testimonial-name\">Antonio Sessa <\/div>\n\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<div class=\"elementor-testimonial-job\">PREDICTOR Doctoral Candidate<\/div>\n\t\t\t\t\t\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t\t\t\t\t\t<\/div>\n\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-c3aa11c elementor-grid-1 elementor-shape-rounded elementor-widget elementor-widget-social-icons\" data-id=\"c3aa11c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"social-icons.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t<div class=\"elementor-social-icons-wrapper elementor-grid\">\n\t\t\t\t\t\t\t<span class=\"elementor-grid-item\">\n\t\t\t\t\t<a class=\"elementor-icon elementor-social-icon elementor-social-icon-linkedin elementor-animation-pop elementor-repeater-item-a21d841\" href=\"https:\/\/www.linkedin.com\/in\/antonio-sessa-319b53286\/\" target=\"_blank\">\n\t\t\t\t\t\t<span class=\"elementor-screen-only\">Linkedin<\/span>\n\t\t\t\t\t\t<svg aria-hidden=\"true\" class=\"e-font-icon-svg e-fab-linkedin\" viewBox=\"0 0 448 512\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M416 32H31.9C14.3 32 0 46.5 0 64.3v383.4C0 465.5 14.3 480 31.9 480H416c17.6 0 32-14.5 32-32.3V64.3c0-17.8-14.4-32.3-32-32.3zM135.4 416H69V202.2h66.5V416zm-33.2-243c-21.3 0-38.5-17.3-38.5-38.5S80.9 96 102.2 96c21.2 0 38.5 17.3 38.5 38.5 0 21.3-17.2 38.5-38.5 38.5zm282.1 243h-66.4V312c0-24.8-.5-56.7-34.5-56.7-34.6 0-39.9 27-39.9 54.9V416h-66.4V202.2h63.7v29.2h.9c8.9-16.8 30.6-34.5 62.9-34.5 67.2 0 79.7 44.3 79.7 101.9V416z\"><\/path><\/svg>\t\t\t\t\t<\/a>\n\t\t\t\t<\/span>\n\t\t\t\t\t<\/div>\n\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-a050a3b e-con-full e-flex e-con e-parent\" data-id=\"a050a3b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t<div class=\"elementor-element elementor-element-48d982d e-con-full animated-fast e-flex elementor-invisible e-con e-child\" data-id=\"48d982d\" data-element_type=\"container\" data-e-type=\"container\" data-settings=\"{&quot;animation&quot;:&quot;fadeInRight&quot;,&quot;animation_delay&quot;:300,&quot;background_background&quot;:&quot;classic&quot;}\">\n\t\t<div class=\"elementor-element elementor-element-e4c4a46 e-con-full e-flex e-con e-child\" data-id=\"e4c4a46\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t<div class=\"elementor-element elementor-element-efffc4d elementor-widget__width-initial elementor-widget elementor-widget-image\" data-id=\"efffc4d\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"image.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<img decoding=\"async\" width=\"800\" height=\"533\" src=\"https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2026\/01\/Flag_of_Italy.svg\" class=\"attachment-large size-large wp-image-1382\" alt=\"\" \/>\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-b583eb7 elementor-widget__width-inherit elementor-widget elementor-widget-heading\" data-id=\"b583eb7\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"heading.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t<h4 class=\"elementor-heading-title elementor-size-default\">Hi! I'm Antonio from Italy,<\/h4>\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-b99b333 e-con-full e-flex e-con e-child\" data-id=\"b99b333\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t<div class=\"elementor-element elementor-element-938f0b9 elementor-widget__width-inherit elementor-widget elementor-widget-heading\" data-id=\"938f0b9\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"heading.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t<h4 class=\"elementor-heading-title elementor-size-default\">and I work at TU Denmark<\/h4>\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-c5af8e1 elementor-widget__width-initial elementor-widget elementor-widget-image\" data-id=\"c5af8e1\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"image.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<img decoding=\"async\" width=\"596\" height=\"842\" src=\"https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2024\/10\/Tegnebraet-1.png\" class=\"attachment-large size-large wp-image-510\" alt=\"\" srcset=\"https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2024\/10\/Tegnebraet-1.png 596w, https:\/\/www.rfb-predictor.eu\/wp-content\/uploads\/2024\/10\/Tegnebraet-1-212x300.png 212w\" sizes=\"(max-width: 596px) 100vw, 596px\" \/>\t\t\t\t\t\t\t\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-112cc22 elementor-widget elementor-widget-n-accordion\" data-id=\"112cc22\" data-element_type=\"widget\" data-e-type=\"widget\" data-settings=\"{&quot;default_state&quot;:&quot;expanded&quot;,&quot;max_items_expended&quot;:&quot;one&quot;,&quot;n_accordion_animation_duration&quot;:{&quot;unit&quot;:&quot;ms&quot;,&quot;size&quot;:400,&quot;sizes&quot;:[]}}\" data-widget_type=\"nested-accordion.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t<div class=\"e-n-accordion\" aria-label=\"Accordion. Open links with Enter or Space, close with Escape, and navigate with Arrow Keys\">\n\t\t\t\t\t\t<details id=\"e-n-accordion-item-1800\" class=\"e-n-accordion-item\" open>\n\t\t\t\t<summary class=\"e-n-accordion-item-title\" data-accordion-index=\"1\" tabindex=\"0\" aria-expanded=\"true\" aria-controls=\"e-n-accordion-item-1800\" >\n\t\t\t\t\t<span class='e-n-accordion-item-title-header'><div class=\"e-n-accordion-item-title-text\"> My academic career <\/div><\/span>\n\t\t\t\t\t\t\t<span class='e-n-accordion-item-title-icon'>\n\t\t\t<span class='e-opened' ><svg aria-hidden=\"true\" class=\"e-font-icon-svg e-fas-minus\" viewBox=\"0 0 448 512\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M416 208H32c-17.67 0-32 14.33-32 32v32c0 17.67 14.33 32 32 32h384c17.67 0 32-14.33 32-32v-32c0-17.67-14.33-32-32-32z\"><\/path><\/svg><\/span>\n\t\t\t<span class='e-closed'><svg aria-hidden=\"true\" class=\"e-font-icon-svg e-fas-plus\" viewBox=\"0 0 448 512\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M416 208H272V64c0-17.67-14.33-32-32-32h-32c-17.67 0-32 14.33-32 32v144H32c-17.67 0-32 14.33-32 32v32c0 17.67 14.33 32 32 32h144v144c0 17.67 14.33 32 32 32h32c17.67 0 32-14.33 32-32V304h144c17.67 0 32-14.33 32-32v-32c0-17.67-14.33-32-32-32z\"><\/path><\/svg><\/span>\n\t\t<\/span>\n\n\t\t\t\t\t\t<\/summary>\n\t\t\t\t<div role=\"region\" aria-labelledby=\"e-n-accordion-item-1800\" class=\"elementor-element elementor-element-c112ca7 e-con-full e-flex e-con e-child\" data-id=\"c112ca7\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t<div class=\"elementor-element elementor-element-4179052 elementor-widget elementor-widget-text-editor\" data-id=\"4179052\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<p><span class=\"TextRun SCXW229532407 BCX8\" lang=\"EN-US\" xml:lang=\"EN-US\" data-contrast=\"auto\"><span class=\"NormalTextRun ContextualSpellingAndGrammarErrorV2Themed SCXW229532407 BCX8\"><strong>Bachelor&#8217;s degree in Chemistry<\/strong> (<span class=\"NormalTextRun SCXW242153547 BCX8\">Universit\u00e0\u00a0<\/span><span class=\"NormalTextRun SCXW242153547 BCX8\">degli<\/span><span class=\"NormalTextRun SCXW242153547 BCX8\"> Studi di Salerno, 2017 &#8211; 2020)<\/span><\/span><\/span><\/p><p><span class=\"TextRun SCXW237980361 BCX8\" lang=\"EN-US\" xml:lang=\"EN-US\" data-contrast=\"auto\"><span class=\"NormalTextRun ContextualSpellingAndGrammarErrorV2Themed SCXW237980361 BCX8\"><strong>Master&#8217;s degree in Chemistry<\/strong> (<span class=\"TextRun SCXW105899496 BCX8\" lang=\"EN-US\" xml:lang=\"EN-US\" data-contrast=\"auto\"><span class=\"NormalTextRun SCXW105899496 BCX8\">Universit\u00e0 di Pisa, 2020 &#8211; 2023)<\/span><\/span><\/span><\/span><\/p><p><span class=\"TextRun SCXW229532407 BCX8\" lang=\"EN-US\" xml:lang=\"EN-US\" data-contrast=\"auto\"><span class=\"NormalTextRun ContextualSpellingAndGrammarErrorV2Themed SCXW229532407 BCX8\"><span class=\"NormalTextRun SCXW242153547 BCX8\"><span class=\"TextRun SCXW92663055 BCX8\" lang=\"EN-US\" xml:lang=\"EN-US\" data-contrast=\"auto\"><span class=\"NormalTextRun SCXW92663055 BCX8\"><strong>Research grant in computational studies of vulcanization process<\/strong> (<span class=\"NormalTextRun SCXW55158372 BCX8\">Universit\u00e0\u00a0<\/span><span class=\"NormalTextRun SCXW55158372 BCX8\">degli<\/span><span class=\"NormalTextRun SCXW55158372 BCX8\">\u00a0Studi\u00a0<\/span><span class=\"NormalTextRun SpellingErrorV2Themed SCXW55158372 BCX8\">dell\u2019Insubria, 2023 &#8211; 2024)<\/span><\/span><\/span><\/span><\/span><\/span><\/p>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/details>\n\t\t\t\t\t\t<details id=\"e-n-accordion-item-1801\" class=\"e-n-accordion-item\" >\n\t\t\t\t<summary class=\"e-n-accordion-item-title\" data-accordion-index=\"2\" tabindex=\"-1\" aria-expanded=\"false\" aria-controls=\"e-n-accordion-item-1801\" >\n\t\t\t\t\t<span class='e-n-accordion-item-title-header'><div class=\"e-n-accordion-item-title-text\"> My publications <\/div><\/span>\n\t\t\t\t\t\t\t<span class='e-n-accordion-item-title-icon'>\n\t\t\t<span class='e-opened' ><svg aria-hidden=\"true\" class=\"e-font-icon-svg e-fas-minus\" viewBox=\"0 0 448 512\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M416 208H32c-17.67 0-32 14.33-32 32v32c0 17.67 14.33 32 32 32h384c17.67 0 32-14.33 32-32v-32c0-17.67-14.33-32-32-32z\"><\/path><\/svg><\/span>\n\t\t\t<span class='e-closed'><svg aria-hidden=\"true\" class=\"e-font-icon-svg e-fas-plus\" viewBox=\"0 0 448 512\" xmlns=\"http:\/\/www.w3.org\/2000\/svg\"><path d=\"M416 208H272V64c0-17.67-14.33-32-32-32h-32c-17.67 0-32 14.33-32 32v144H32c-17.67 0-32 14.33-32 32v32c0 17.67 14.33 32 32 32h144v144c0 17.67 14.33 32 32 32h32c17.67 0 32-14.33 32-32V304h144c17.67 0 32-14.33 32-32v-32c0-17.67-14.33-32-32-32z\"><\/path><\/svg><\/span>\n\t\t<\/span>\n\n\t\t\t\t\t\t<\/summary>\n\t\t\t\t<div role=\"region\" aria-labelledby=\"e-n-accordion-item-1801\" class=\"elementor-element elementor-element-205b674 e-con-full e-flex e-con e-child\" data-id=\"205b674\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a3a9cd8 elementor-widget elementor-widget-text-editor\" data-id=\"a3a9cd8\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<p>coming soon<\/p>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/details>\n\t\t\t\t\t<\/div>\n\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-4b14ba9 e-con-full animated-fast e-flex elementor-invisible e-con e-child\" data-id=\"4b14ba9\" data-element_type=\"container\" data-e-type=\"container\" data-settings=\"{&quot;animation&quot;:&quot;fadeInRight&quot;,&quot;animation_delay&quot;:300,&quot;background_background&quot;:&quot;classic&quot;}\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a5d7d71 elementor-widget__width-inherit elementor-widget elementor-widget-heading\" data-id=\"a5d7d71\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"heading.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t<h1 class=\"elementor-heading-title elementor-size-default\">About my thesis - \nStability of flow battery electrolytes<\/h1>\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-e3d9ea1 elementor-widget elementor-widget-text-editor\" data-id=\"e3d9ea1\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<p>The capacity fade in organic redox flow batteries (ORFBs) is mainly caused by the degradation of their organic components. Predicting how these molecules evolve is fundamental to understanding their suitability for energy storage applications. In this project I aim to develop a modeling and simulation tool for the screening of degradation mechanisms of redox-active molecules.<\/p><p>The idea is to create a tool capable of exploring all the possible reaction pathways that transform the components of an electrolyte cell <br \/>(redox-active molecules, solvent, and occasionally salt) into other species. Key aspects will be the determination of the possible reactive sites on the molecules and Transition State search. It is pivotal to automate the processes and eliminate the trial and error approach in favor of an automated system while maintaining chemical intuition. This makes it possible to identify the reaction network without missing critical products and pathways.<\/p><p>For this purpose, I will employ a single-ended Transition State search method to explore the potential energy surface (PES), through an algorithm implemented in the Amsterdam Simulation Suite (AMS). The idea is to use semi-empirical methods (such as DFTB) to efficiently evaluate reaction pathways and then use more accurate methods (DFT) to refine the results. As the dataset expands, machine learning techniques may be integrated to accelerate predictions, enhancing the efficiency of degradation analyses in RFBs<\/p>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t","protected":false},"excerpt":{"rendered":"<p>\u201cI really enjoy contributing to this project from a computational perspective, and I hope that the technology we aim to create can pave the way for the exploration of tons of new organics to be used in ORFBs. What is most exciting for me is the opportunity to discuss and collaborate with people who have [&hellip;]<\/p>\n","protected":false},"author":1,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"class_list":["post-1172","page","type-page","status-publish","hentry"],"_links":{"self":[{"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=\/wp\/v2\/pages\/1172","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=1172"}],"version-history":[{"count":23,"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=\/wp\/v2\/pages\/1172\/revisions"}],"predecessor-version":[{"id":1579,"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=\/wp\/v2\/pages\/1172\/revisions\/1579"}],"wp:attachment":[{"href":"https:\/\/www.rfb-predictor.eu\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=1172"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}