Activities per year
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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Revealing the Sunset Dance of a Push-Pull Stilbene on an Amorphous Silica Glass Surface
Dóra Vörös (Contributor), F. Proché (Contributor), Andrea Angeletti (Contributor), Sebastian Mai (Contributor), Cesare Franchini (Contributor) & Leticia Gonzalez Herrero (Contributor)
17 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
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Spatial distribution of interacting defects using Machine Learning
Cesare Franchini (Speaker)
24 Sep 2023 → 27 Sep 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Long-range Electrostatic Descriptors for Machine Learning Force Fields
Carolin Faller (Speaker)
24 Sep 2023 → 27 Sep 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Automatic real-space lattice Extraction and atom counting for AFM images
Marco Corrias (Speaker)
24 Sep 2023 → 27 Sep 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Polarons and Defects via Machine Learning: Predicting the TiO$_2$(110) Surface at the Large Scale
Viktor Christian Birschitzky (Speaker)
24 Sep 2023 → 27 Sep 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Computational Modelling of Quantum Oxides
Cesare Franchini (Speaker)
17 Sep 2023 → 20 Sep 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Multipolar magnetism in spin-orbit entangled oxides
Cesare Franchini (Speaker)
4 Sep 2023 → 8 Sep 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Auxiliary Field Quantum Monte Carlo: towards chemical precision in solids
Georg Kresse (Speaker)
17 Aug 2023 → 18 Aug 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Polarons in Magnetic Materials
Michele Reticcioli (Speaker)
Aug 2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Exploring How Molecules Interact with Surfaces: A Study of Push-Pull Functionalized Stilbene on Silica Glass
Dóra Vörös (Contributor), F. Proché (Contributor), Andrea Angeletti (Contributor), Cesare Franchini (Contributor), Sebastian Mai (Contributor) & Leticia Gonzalez Herrero (Contributor)
6 Jul 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Automatic real-space lattice Extraction and atom counting for AFM images
Marco Corrias (Speaker)
3 Jul 2023 → 7 Jul 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Electronic States and Polarons on Polar Surfaces
Michele Reticcioli (Speaker)
Jul 2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Automatic real-space lattice Extraction and atom counting for AFM images
Marco Corrias (Speaker)
23 May 2023 → 26 May 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Automatic real-space lattice Extraction and atom counting for AFM images
Marco Corrias (Speaker)
22 May 2023 → 26 May 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Janh-Teller polaron in a spin-orbit multipolar magnetic oxide Ba2NaOsO6
Cesare Franchini (Speaker)
4 May 2023 → 11 May 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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An orbital-based representation for accurate Quantum Machine Learning
Konstantin Karandashev (Speaker)
19 Apr 2023 → 21 Apr 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Understanding structure property relations from a quantum alchemy based atomic partitioning scheme
Michael Sahre (Contributor), Guido Falk von Rudorff (Contributor), Otto Anatole von Lilienfeld-Toal (Contributor) & Philipp Marquetand (Contributor)
20 Mar 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Understanding the role of amorphous SiO2 surface on the ad(b)sorption of a photoswitcher DANSing molecule
Dóra Vörös (Contributor), Andrea Angeletti (Contributor), Cesare Franchini (Contributor), Sebastian Mai (Contributor) & Leticia Gonzalez Herrero (Contributor)
20 Mar 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Polarons and the Surface Reactivity of Oxides: Recent Results and Novel Computational Approaches
Michele Reticcioli (Speaker)
Mar 2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Electronic States and Polarons on Polar Surfaces
Michele Reticcioli (Speaker)
Mar 2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Total Variation Denoising and Microscopy Image Analysis
Marco Corrias (Speaker)
13 Feb 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Machine Learning the Polaron-Defect Interaction: Oxygen Vacancies on Rutile TiO2(110)
Viktor Christian Birschitzky (Speaker)
12 Feb 2023 → 15 Feb 2023Activity: Talks and presentations › Poster presentation › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
12 Feb 2023 → 15 Feb 2023Activity: Talks and presentations › Poster presentation › Science to Science
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DANSers - How does a push-pull functionalized stilbene adsorb and absorb on a silica glass surface?
Dóra Vörös (Invited speaker), F. Proché (Contributor), Andrea Angeletti (Contributor), Cesare Franchini (Contributor), Sebastian Mai (Contributor) & Leticia Gonzalez Herrero (Contributor)
1 Feb 2023Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Janh-Teller polaron in the spin-orbit multipolar magnetic oxide Ba2NaOsO6
Lorenzo Celiberti (Speaker)
2023 → …Activity: Talks and presentations › Poster presentation › Science to Science
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Anti-Relativistic Jahn-Teller Polaron in a Spin-Orbit Entangled Oxide
Lorenzo Celiberti (Speaker)
2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Janh-Teller polaron in the spin-orbit multipolar magnetic oxide Ba2NaOsO6
Lorenzo Celiberti (Speaker)
2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Polarons in Quantum Magnets
Lorenzo Celiberti (Speaker)
2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Janh-Teller polaron in the spin-orbit multipolar magnetic oxide Ba2NaOsO6
Lorenzo Celiberti (Speaker)
2023 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
26 Sep 2022 → 30 Sep 2022Activity: Talks and presentations › Poster presentation › Science to Science
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4-(N,N-Dimethylamino)-4'-Nitrostilbene on an Amorphous Silica Glass Surface and its Photochemistry
Dóra Vörös (Contributor), Andrea Angeletti (Contributor), Cesare Franchini (Contributor), Sebastian Mai (Contributor) & Leticia Gonzalez Herrero (Contributor)
18 Sep 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Understanding covalent bonding with computational alchemy
Michael Sahre (Contributor), Guido Falk von Rudorff (Contributor) & A. von Lilienfeld (Contributor)
18 Sep 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Short lifetime of a monovacancy in phosphorene
Lukas Kyvala (Contributor), Andrea Angeletti (Contributor), Cesare Franchini (Contributor) & Christoph Dellago (Contributor)
14 Sep 2022 → 16 Sep 2022Activity: Talks and presentations › Poster presentation › Science to Science
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An orbital-based representation of changes in electronic structure for improved Δ-machine learning approaches
Konstantin Karandashev (Speaker)
6 Sep 2022 → 9 Sep 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Distribution of Charge and Lattice Defects via Machine Learning
Michele Reticcioli (Speaker)
Sep 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Novel Polaronic Effects in Perovskites
Michele Reticcioli (Speaker)
Sep 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Machine learning density functionals from the random-phase approximation
Stefan Riemelmoser (Speaker)
23 Aug 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Zero-point Renormalization of the Band Gap of Semiconductors and Insulators Using the PAW Method
Manuel Engel (Speaker)
22 Aug 2022 → 25 Aug 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
22 Aug 2022 → 25 Aug 2022Activity: Talks and presentations › Poster presentation › Science to Science
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An orbital-based representation of changes in electronic structure for improved Δ-machine learning approaches
Konstantin Karandashev (Speaker)
22 Aug 2022 → 25 Aug 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Spontaneous Charge Localization on Polar Surfaces
Michele Reticcioli (Speaker)
Aug 2022 → …Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Monovacancies in phosphorene: molecular dynamics study via machine learning
Lukas Kyvala (Contributor), Andrea Angeletti (Contributor), Cesare Franchini (Contributor) & Christoph Dellago (Contributor)
13 Jun 2022 → 15 Jun 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Spontaneous Localization of Intrinsic Excess Charge on Polar Surfaces
Michele Reticcioli (Speaker)
Jun 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Adsorption of 4-(N,N-Dimethylamino)-4′- nitrostilbene on amorphous silica glass surface
Dóra Vörös (Speaker), Andrea Angeletti (Contributor), Cesare Franchini (Contributor), Sebastian Mai (Contributor) & Leticia Gonzalez Herrero (Contributor)
31 May 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Hard antiphase domain boundaries in strontium titanate unravelled using machine-learned force fields
Andreas Tröster (Contributor), Carla Verdi (Contributor), Christoph Dellago (Contributor), Georg Kresse (Contributor) & Wilfried Schranz (Contributor)
3 Apr 2022 → 6 Apr 2022Activity: Talks and presentations › Poster presentation › Science to Science
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Machine learning density functionals from the random-phase approximation
Stefan Riemelmoser (Speaker)
17 Mar 2022Activity: Talks and presentations › Talk or oral contribution › Science to Science
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Spin-Orbit coupled polaron in a 5d1 Osmate
Lorenzo Celiberti (Speaker)
2022 → …Activity: Talks and presentations › Poster presentation › Science to Science