Skip to main content
Go to the home page of the European Commission (opens in new window)
English English
CORDIS - EU research results
CORDIS

Machine learning methods for excited-state dynamics simulations in light-induced spin-crossover complexes

Objective

Spin crossover complexes are bistable transition-metal compounds in which light, or other external simuli, is used to induce a change in the magnetic state of the system, allowing them to be employed as molecular switches in future spintronics and photonics technologies. Despite the rapid development of experimental techniques to characterise these complexes, computational material science is not yet able to provide a quantitative description of the light-induced spin crossover mechanism. These limitations are mainly due to the need for enormous computational resources to perform accurate excited-state dynamics simulations in medium-sized transition-metal complexes. The aim of the SCOML project is to provide the proof of concept for a new machine learning-based strategy that will enable efficient and accurate simulations of the light-induced spin-crossover mechanism, thus paving the way for a systematic design of new materials. Achieving this goal has the potential to revolutionise the production of new technological solutions to guide Europe towards a digital and green transition.

Fields of science (EuroSciVoc)

CORDIS classifies projects with EuroSciVoc, a multilingual taxonomy of fields of science, through a semi-automatic process based on NLP techniques. See: The European Science Vocabulary.

You need to log in or register to use this function

Keywords

Project’s keywords as indicated by the project coordinator. Not to be confused with the EuroSciVoc taxonomy (Fields of science)

Programme(s)

Multi-annual funding programmes that define the EU’s priorities for research and innovation.

Topic(s)

Calls for proposals are divided into topics. A topic defines a specific subject or area for which applicants can submit proposals. The description of a topic comprises its specific scope and the expected impact of the funded project.

Funding Scheme

Funding scheme (or “Type of Action”) inside a programme with common features. It specifies: the scope of what is funded; the reimbursement rate; specific evaluation criteria to qualify for funding; and the use of simplified forms of costs like lump sums.

HORIZON-TMA-MSCA-PF-EF - HORIZON TMA MSCA Postdoctoral Fellowships - European Fellowships

See all projects funded under this funding scheme

Call for proposal

Procedure for inviting applicants to submit project proposals, with the aim of receiving EU funding.

(opens in new window) HORIZON-MSCA-2022-PF-01

See all projects funded under this call

Coordinator

THE PROVOST, FELLOWS, FOUNDATION SCHOLARS & THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY & UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN
Net EU contribution

Net EU financial contribution. The sum of money that the participant receives, deducted by the EU contribution to its linked third party. It considers the distribution of the EU financial contribution between direct beneficiaries of the project and other types of participants, like third-party participants.

€ 199 694,40
Address
COLLEGE GREEN TRINITY COLLEGE
D02 CX56 Dublin
Ireland

See on map

Region
Ireland Eastern and Midland Dublin
Activity type
Higher or Secondary Education Establishments
Links
Total cost

The total costs incurred by this organisation to participate in the project, including direct and indirect costs. This amount is a subset of the overall project budget.

No data

Partners (1)

My booklet 0 0