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Fabian Schwarz

@fabianmrblack.bsky.social
69 followers 103 following 18 posts

Computational Chemistry & Materials Science | Postdoc Uppsala University 🇸🇪 | Former PhD Student @LNM ETHZ 🇨🇭 | Sverige | 🗣️: 🇨🇭🇩🇪🇬🇧🇸🇪

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Reposted by Fabian Schwarz
Mark A. Hanson @hansonmark.bsky.social · 13/01/2026
We've got ISSUES. Literally. We scraped >100k special issues & over 1 million articles to bring you a PISS-poor paper. We quantify just how many excess papers are published by guest editors abusing special issues to boost their CVs. How bad is it & what can we do? arxiv.org/abs/2601.07563 A 🧵 1/n
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Reposted by Fabian Schwarz
MOF Papers @mofpapers.bsky.social · 29/12/2025
Lattice Oxygen Exchange Pathways in Nickel–Iron Metal–Organic Framework-Based Oxygen Evolution Electrocatalysts dx.doi.org/10.1021/acsami.5c12947
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Fabian Schwarz @fabianmrblack.bsky.social · 29/12/2025
A big effort to better understand lattice oxygen exchange and oxygen evolution reaction in Ni-Fe MHOFs. Vibrational mode calculations supplement the experimental Raman Spectra, helping to eluciadte the proposed reaction mechanism. #chemsky #compchemsky pubs.acs.org/doi/10.1021/...
pubs.acs.org
Lattice Oxygen Exchange Pathways in Nickel–Iron Metal–Organic Framework-Based Oxygen Evolution Electrocatalysts
The oxygen evolution reaction (OER) is crucial for electrofuel production. Metal–hydroxide organic frameworks (MHOFs), a subset of metal–organic frameworks with oxyhydroxide-like layers interconnected...
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Fabian Schwarz @fabianmrblack.bsky.social · 18/12/2025
Tim developed a python package which includes a variety of tools for coarse-grained polymer simulations. It includes network generation, fast implementations for determining shear moduli and normal mode analysis as well as analysis of (MD) simulation output. #compchemsky doi.org/10.5334/jors...
doi.org
pylimer-tools: A Python Package for Generating and Analyzing Bead-Spring Polymer Networks | Journal of Open Research Software
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Fabian Schwarz @fabianmrblack.bsky.social · 29/11/2025
To elucidate where the water and sodium are located, Ida did some inelastic neutron scattering, comparing it with simulated spectra. #chemsky Vibrational Water Dynamics in Sodium-Based Prussian Blue Analogues | The Journal of Physical Chemistry C pubs.acs.org/doi/10.1021/...
pubs.acs.org
Vibrational Water Dynamics in Sodium-Based Prussian Blue Analogues
The Prussian blue analogues (PBAs) Na2-xFe[Fe(CN)6]·z H2O (x,z = 0–2) exhibit many phase transitions as a function of the sodium and water content, which involves large volume changes that can negativ...
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Fabian Schwarz @fabianmrblack.bsky.social · 03/09/2025
Hannes' manuscript about our methodology to study ion diffusion in crystalline solids has just been published. The interaction of the ions with the framework can in principle be calculated at any level of theory. #compchem #compchemsky doi.org/10.1021/acs....
doi.org
Computationally Efficient DFT-Based Sampling of Ion Diffusion in Crystalline Solids
We present a method for large-scale DFT-based screening of ion diffusion in crystalline solids. This is accomplished by extending the Ionic TuTraSt method to sample the potential energy surface by usi...
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Fabian Schwarz @fabianmrblack.bsky.social · 08/05/2025
Great work from Nensi and all other co-authors mapping out a wide range of stoichiometries and combining insights from experiment with those from MD simulations! #chemsky #matsky #compchem
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Fabian Schwarz @fabianmrblack.bsky.social · 02/04/2025
While the title is "...; the existence of the postdoc", @jacoates.bsky.social discusses many of academia's problems. The least we can do is bring it up again and again. open.spotify.com/episode/1iv8...
open.spotify.com
Pressure, precarity and paucity; the existence of the postdoc
Preprints in Motion · Episode
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Fabian Schwarz @fabianmrblack.bsky.social · 26/02/2025
ESC's mascot LUMO is something for #chemsky So sieht das Maskottchen «Lumo» des ESC 2025 aus www.watson.ch/!233664186
watson.ch
So sieht das Maskottchen «Lumo» des ESC 2025 aus
Das Maskottchen des Eurovision Song Contest (ESC) 2025 in Basel heisst «Lumo» und ist ein Herzchen auf zwei Beinen mit feurig-rotem Haarbusch.
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Reposted by Fabian Schwarz
Laboratory for Nanometallurgy - ETH Zürich @lnm-eth.bsky.social · 21/02/2025
🚨Check out our latest publication in @NanoLetters! @Jelena_Wohlwend and @Oliverwipf present Cu-Pd disordered network #metamaterials as a scalable platform for plasmonic catalysis. 👉 doi.org/10.1021/acs.... @ethzurich.bsky.social @cenmag.bsky.social
doi.org
CO2 Conversion in Cu–Pd Based Disordered Network Metamaterials with Ultrasmall Mode Volumes
Plasmons can drive chemical reactions by directly exciting intramolecular transitions. However, strong coupling of plasmons to single molecules remains a challenge as ultrasmall mode volumes are required. In the presented work, we propose Cu–Pd plasmonic network metamaterials as scalable platforms for plasmon-assisted catalysis. Due to the absence of translational symmetry, these networks provide a unique plasmonic environment featuring a large local density of optical states and an unparalleled density of hotspots that effectively localizes light in mode volumes V < 8 × 10–24 m3. Catalytic performance tests during CO2 conversion reveal production rates of up to 4.3 × 102 mmol g–1 h–1 and altered reaction selectivity under light illumination. Importantly, we show that the selectivity of the catalytic process can be tuned by modifying the network’s chemical composition, offering a versatile approach to optimize reaction pathways.
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Fabian Schwarz @fabianmrblack.bsky.social · 07/12/2024
A winter afternoon in Uppsala.
Image taken this afternoon in Uppsala. The river Fyris and a little snow in the foreground, Uppsala Cathedral and the moon in the background.
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Fabian Schwarz @fabianmrblack.bsky.social · 02/12/2024
Sunrise in Uppsala.
Sunrise over the river Fyris in Uppsala with a nice red shine.Sunrise over the river Fyris in Uppsala with a nice red shine
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Fabian Schwarz @fabianmrblack.bsky.social · 22/11/2024
Our perspective on how the potential energy surface can aid in the understanding of diffusion in solid-state materials has just been published in Chemistry of Materials. #chemsky #compchemsky doi.org/10.1021/acs....
doi.org
Understanding Mobile Particles in Solid-State Materials: From the Perspective of Potential Energy Surfaces
The structure and dynamics of a material are essentially determined by the complex combination of potential energy landscapes experienced by the individual atoms in the system. In turn, valuable infor...
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Fabian Schwarz @fabianmrblack.bsky.social · 16/11/2024
Fin kväll i Uppsala. #AlltLjusPåUppsala
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