Publications
2024
CO-Induced Dimer Decay Responsible for Gem-Dicarbonyl Formation on a Model Single-Atom Catalyst. / Wang, Chunlei; Sombut, Panukorn; Puntscher, Lena et al.
In: Angewandte Chemie - International Edition, Vol. 63, No. 16, e202317347, 15.04.2024.Publications: Contribution to journal › Article › peer-review
Fungal Carbon: A Cost-Effective Tunable Network Template for Creating Supercapacitors. / Jones, Mitchell P. (Corresponding author); Jiang, Qixiang; Mautner, Andreas et al.
In: Global Challenges, Vol. 8, No. 4, 2300315, 11.04.2024.Publications: Contribution to journal › Article › peer-review
Layer-by-layer phase transformation in Ti3O5 revealed by machine-learning molecular dynamics simulations. / Liu, Mingfeng; Wang, Jiantao; Hu, Junwei et al.
In: Nature Communications, Vol. 15, 3079, 09.04.2024.Publications: Contribution to journal › Article › peer-review
Microporosity evolution in polymer-derived SiOC glasses pyrolyzed in different atmospheres. / Cassetta, Michele (Corresponding author); Peterlik, Herwig (Corresponding author); Konegger, Thomas et al.
In: Journal of the American Ceramic Society, 09.04.2024.Publications: Contribution to journal › Article › peer-review
Effects of Linking Topology on the Shear Response of Connected Ring Polymers: Catenanes and Bonded Rings Flow Differently. / Farimani, Reyhaneh A.; Ahmadian Dehaghani, Zahra; Likos, Christos N. et al.
In: Physical Review Letters, Vol. 132, No. 14, 148101, 05.04.2024.Publications: Contribution to journal › Article › peer-review
Resonance energy transfer in orthogonally arranged chromophores: a question of molecular representation. / Jacobi, Richard; González, Leticia (Corresponding author).
In: Physical Chemistry Chemical Physics, Vol. 26, No. 16, 28.04.2024, p. 12299-12305.Publications: Contribution to journal › Article › peer-review
Drug design on quantum computers. / Santagati, Raffaele (Corresponding author); Aspuru-Guzik, Alan; Babbush, Ryan et al.
In: Nature Physics, Vol. 20, No. 4, 04.2024, p. 549-557.Publications: Contribution to journal › Article › peer-review
Enhanced Sampling of Configuration and Path Space in a Generalized Ensemble by Shooting Point Exchange. / Falkner, Sebastian; Coretti, Alessandro; Dellago, Christoph (Corresponding author).
In: Physical Review Letters, Vol. 132, No. 12, 128001, 22.03.2024.Publications: Contribution to journal › Article › peer-review
Transparent PDMS Surfaces with Covalently Attached Lubricants for Enhanced Anti-adhesion Performance. / Eder, Tanja; Mautner, Andreas; Xu, Yufeng et al.
In: ACS Applied Materials and Interfaces, Vol. 16, No. 8, 28.02.2024, p. 10942-10952.Publications: Contribution to journal › Article › peer-review
Interpenetrated and Bridged Nanocylinders from Self-Assembled Star Block Copolymers. / Moghimi, Esmaeel; Chubak, Iurii; Ntetsikas, Konstantinos et al.
In: Macromolecules, Vol. 57, No. 3, 13.02.2024, p. 926-939.Publications: Contribution to journal › Article › peer-review
Unraveling the govering properties of confined carbyne through the interaction with its carbon nanotube host. / Cui, Weili; Ayala, Paola; Pichler, Thomas (Corresponding author) et al.
In: Carbon, Vol. 219, 118784, 10.02.2024.Publications: Contribution to journal › Article › peer-review
Quasiparticle and excitonic properties of monolayer SrTiO3. / Varrassi, Lorenzo (Corresponding author); Liu, Peitao; Franchini, Cesare.
In: Physical Review Materials, Vol. 8, No. 2, 024001, 02.2024.Publications: Contribution to journal › Article › peer-review
Retain strength, gain ductility: tough and transparent nanopapers by mercerisation. / Mayer, Florian; Prado-Roller, Alexander; Mautner, Andreas (Corresponding author) et al.
In: Cellulose, Vol. 31, No. 3, 02.2024, p. 1533-1544.Publications: Contribution to journal › Article › peer-review
Carbon nano-onions: Individualization and enhanced water dispersibility. / Lucherelli, Matteo Andrea (Corresponding author); Stiegler, Lisa M.S.; Steiger, Florian et al.
In: Carbon, Vol. 218, 118760, 31.01.2024.Publications: Contribution to journal › Article › peer-review
The Mott transition in the 5d1 compound Ba2NaOsO6: a DFT+DMFT study with PAW spinor projectors. / Fiore Mosca, Dario (Corresponding author); Schnait, Hermann; Celiberti, Lorenzo et al.
In: Computational Materials Science, Vol. 233, 112764, 30.01.2024.Publications: Contribution to journal › Article › peer-review
Lipid Monolayer on Cell Surface Protein Templates Functional Extracellular Lipid Assembly. / Dwivedi, Anupma; Mazumder, Anisha; Pullmannová, Petra et al.
In: Small, 20.01.2024.Publications: Contribution to journal › Article › peer-review
Two-dimensional few-atom noble gas clusters in a graphene sandwich. / Längle, Manuel (Corresponding author); Mizohata, Kenichiro; Mangler, Clemens et al.
In: Nature Materials, 11.01.2024.Publications: Contribution to journal › Article › peer-review
Controlling the coarsening dynamics of ferrogranulate networks by means of the filling fraction—Less is more susceptible. / Lakkis, Ali (Corresponding author); Biersack, Matthias; Bilous, Oksana et al.
In: Journal of Magnetism and Magnetic Materials, Vol. 589, 171620, 01.01.2024.Publications: Contribution to journal › Article › peer-review
In silico study of area fraction effects on the behaviour of a ferrogranulate layer in an orthogonal applied field. / Bilous, Oksana (Corresponding author); Okrugin, Kirill A.; Lakkis, Ali et al.
In: Journal of Magnetism and Magnetic Materials, Vol. 589, 171627, 01.01.2024.Publications: Contribution to journal › Article › peer-review
Colloidal gelation induced by ring polymers. / Moghimi, Esmaeel; Chubak, Iurii; Kaliva, Maria et al.
In: Physical Review Research, Vol. 6, No. 1, 013079, 01.2024.Publications: Contribution to journal › Article › peer-review