CORDIS fornisce collegamenti ai risultati finali pubblici e alle pubblicazioni dei progetti ORIZZONTE.
I link ai risultati e alle pubblicazioni dei progetti del 7° PQ, così come i link ad alcuni tipi di risultati specifici come dataset e software, sono recuperati dinamicamente da .OpenAIRE .
Risultati finali
A report on new code capabilities released as part of the next major FHI-aims code release.
Manuscript describing the prediction of core electron binding energies in complex molecules (si apre in una nuova finestra)A manuscript describing the prediction of core electron binding energies in complex molecules, including a qualitative and quantitative assessment of the accuracy of the calculated binding energies, that also addresses any specific challenges that may arise in such calculations, e.g. problems in core hole localization, the treatment of systems with unpaired electrons in the ground state, or any issues specific to gas phase ion pairs (present in the vapours of ionic liquids), such as possible spurious charge transfer from the anion to the cation through vacuum when a localized core hole is created on the cation.
A library of numerical basis sets, distributed with FHI-aims, and also uploaded to the NOMAD repository
Dissemination and exploitation plan (si apre in una nuova finestra)Plan for the dissemination and exploitation of results, including communication activities.
A website for the BETTERXPS project.
Data management plan submitted at mid-term, and an update towards the end of the project if needed.
Pubblicazioni
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