Projects per year
UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. Our work contributes towards the following SDG(s):
Collaborations and top research areas from the last five years
Recent external collaboration on country/territory level. Dive into details by clicking on the dots or
Persons
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Sajad Bazrafshan
- Faculty of Physics, Computational Materials Physics - Academic third-party funded project staff
Person: Academic staff
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Lorenzo Celiberti
- Faculty of Physics, Computational Materials Physics - Academic third-party funded project staff, External lecturer
Person: Academic staff
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TACO: Taming Complexity in Materials Modeling
Diebold, U., Kresse, G., Mezger-Backus, E. H. G., Dellago, C. & Franchini, C.
1/03/21 → 28/02/25
Project: Research funding
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DCAFM : Doctoral College Advanced Functional Materials
Dellago, C., Ayala, P., Arndt, M., Bismarck, A., Franchini, C., Gonzalez Herrero, L., Kantorovich, S., Kotakoski, J., Kresse, G., Likos, C., Pichler, T. & Rennhofer, C.
1/10/20 → 30/09/24
Project: Research funding
Publications
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Analytic method for quadratic polarons in nonparabolic bands
Klimin, S. N., Tempere, J., Houtput, M., Ragni, S., Hahn, T., Franchini, C. & Mishchenko, A. S., 15 Aug 2024, In: Physical Review B. 110, 7, 13 p., 075107.Publications: Contribution to journal › Article › Peer Reviewed
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CO-Induced Dimer Decay Responsible for Gem-Dicarbonyl Formation on a Model Single-Atom Catalyst
Wang, C., Sombut, P., Puntscher, L., Jakub, Z., Meier, M., Pavelec, J., Bliem, R., Schmid, M., Diebold, U., Franchini, C. & Parkinson, G. S., 15 Apr 2024, In: Angewandte Chemie - International Edition. 63, 16, 9 p., e202317347.Publications: Contribution to journal › Article › Peer Reviewed
Open Access -
Extending the definition of atomic basis sets to atoms with fractional nuclear charge
Domenichini, G., 28 Mar 2024, In: Journal of Chemical Physics. 160, 12, 7 p., 124107.Publications: Contribution to journal › Article › Peer Reviewed
Open Access
Activities
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Collective interactions in magnetic transition metal oxides
Cesare Franchini (Speaker)
26 Nov 2023 → 29 Nov 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Overview of UNIVIE in BIG-MAP
Konstantin Karandashev (Speaker)
24 Oct 2023 → 25 Oct 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Long-range Electrostatic Descriptors for Machine Learning Force Fields
Carolin Faller (Speaker)
17 Oct 2023Activity: Talks and presentations › Poster presentation › Science to Science
Prizes
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2017 JCP Editors’ Choice collection
Schäfer, Tobias (Recipient), Aug 2017
Prize: Prize, award or honor
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Press/Media
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Atomic motion captured on-the-fly by machine learning
Menno Bokdam
25/06/19
1 Media contribution
Press/Media: Research
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Geheimnisvolle Oberfläche
Ulrike Diebold, Cesare Franchini & Xianfeng Hao
22/03/14
1 item of Media coverage
Press/Media: Research