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Automatic generation of Chemical Models

Deliverables

Creation of website and social media sites

Public online presence of the network. Connected to D6.4.

Website published, social media pages established

Visible online presence of the network.

Advertisement of ESR positions

The ESR positions will be advertised through different channels, including EURAXESS.

Presentations (oral and poster) at international conferences

The dissemination of results will include presentations in scientific and industrial conferences.

Scientific publications

The dissemination of results will include publication in scientific journals.

Recruitment workshop

Candidates to ESR positions will be invited to a workshop organized along with the kickoff meeting.

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Publications

Correcting Rate Constants from Anharmonic Molecular Dynamics for Quantum Effects

Author(s): Felix Schmalz, Wassja A. Kopp, Leif C. Kröger, Kai Leonhard
Published in: ACS Omega, Issue 5/5, 2020, Page(s) 2242-2253, ISSN 2470-1343
DOI: 10.1021/acsomega.9b03383