Objective
Research objectives and content One of the central goals in chemical physics is to understand the nature of Intramolecular vibrational energy relaxation (IVR). Some recent spectroscopic and experimental studies have provided some ro-vibrational spectra of molecules such has CF3H and CHFO. But a better resolution of the spectrum increases the difficulty in assigning its features. Consequently, it becomes curtail to develop methods which allow to compute the vibrational spectrum without doing drastic assumptions, by example neglecting some vibrational modes or the ro-vibrational couplings. Up to now, the theoretical works on IVR have neglected either some vibrational modes or the Coriolis coupling s. Our research studies consists in developing a numerical approach to compute 'ab initio' spectra and to perform IVR calculations in a curvilinear description for tetra and pentaatomic molecules. Therefore, we will be able to establish a link between the spectrum feature and the nature of the IVR by studying different systems such as NF3, CHFO and CF3H at various levels of excitation. Training content (objective, benefit and expected impact) It would be an opportunity to collaborate with a leading group in the area, to reach high computational skills and in-depth physical grounds for the ro-vibrational process of simple molecules. Links with industry / industrial relevance (22)
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.
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.
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Programme(s)
Multi-annual funding programmes that define the EU’s priorities for research and innovation.
Multi-annual funding programmes that define the EU’s priorities for research and innovation.
Topic(s)
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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.
Call for proposal
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Procedure for inviting applicants to submit project proposals, with the aim of receiving EU funding.
Funding Scheme
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Coordinator
54006 Thessaloniki
Greece
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