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Related publications (30)

Large effect of metal substrate on magnetic anisotropy of Co on hexagonal boron nitride

Harald Brune, Stefano Rusponi, Christian Wäckerlin, Jan Gui-Hyon Dreiser, Fabio Donati, Aparajita Singha, Romana Baltic

We combine x-ray absorption spectroscopy (XAS), x-raymagnetic circular dichroism (XMCD) and x-ray magnetic linear dichroism (XMLD) data with first principles density functional theory (DFT) calculations and amultiorbital many-body Hamiltonian approach to u ...

2019

Functional Extrapolations to Tame Unbound Anions in Density-Functional Theory Calculations

Nicola Marzari, Oliviero Andreussi, Francesco Nattino

Standard flavors of density-functional theory (DFT) calculations are known to fail in describing anions, due to large self-interaction errors. The problem may be circumvented using localized basis sets of reduced size, leaving no variational flexibility fo ...

AMER CHEMICAL SOC2019

ELM-induced cold pulse propagation in ASDEX Upgrade

Olivier Sauter, Basil Duval, Stefano Coda, Timothy Goodman, Yves Martin, Jean-Marc Moret, Duccio Testa, Patrick Blanchard, Holger Reimerdes, Benoît Labit, Christian Gabriel Theiler, Laurie Porte, Alessandro Pau, Alexander Karpushov, Federico Alberto Alfredo Felici, Antoine Pierre Emmanuel Alexis Merle, Cristian Sommariva, Joan Decker, Umar Sheikh, Marc Gruber, Cristian Galperti, Yanis Andrebe, Pedro Andres Molina Cabrera, Roland Behn, Nicola Vianello, Federico Nespoli, Richard Pitts, Cedric Kar-Wai Tsui, Yann Camenen, Doohyun Kim, Jan Horacek, Wouter Vijvers, Anna Teplukhina, Javier García Hernández, Zhouji Huang, Marco Wischmeier, Claudio Marini, Hoang Bao Le, Himank Anand, Matteo Fontana, Antonio José Pereira de Figueiredo, , , , , , , , , , , ,

Capsule networks, but not convolutional networks explain global configurational visual effects

Michael Herzog, Adrien Christophe Doerig, Alban Bornet

In human vision, perception of local features depends on all elements in the visual field and their exact configuration. For example, observers performed a vernier discrimination task. When a surrounding square was added to the vernier, the task became muc ...

2019

Visual Correspondences for Unsupervised Domain Adaptation on Electron Microscopy Images

Pascal Fua, Mathieu Salzmann, Carlos Joaquin Becker, Róger Bermúdez Chacón, Okan Altingövde

We present an Unsupervised Domain Adaptation strategy to compensate for domain shifts on Electron Microscopy volumes. Our method aggregates visual correspondences—motifs that are visually similar across different acquisitions—to infer changes on the parame ...

Institute of Electrical and Electronics Engineers2020

Basic gestalt laws cannot explain uncrowding

Michael Herzog, Oh-Hyeon Choung, Einat Rashal

Visual crowding is the inability to perceive elements within clutter. Traditional crowding models, such as pooling, predict that performance deteriorates when flankers are added. However, this prediction has been disproved. For example, performance was fou ...

SAGE PUBLICATIONS LTD2019

Libraries of Extremely Localized Molecular Orbitals. 3. Construction and Preliminary Assessment of the New Databanks

Benjamin André René Meyer

The fast and reliable determination of wave functions and electron densities of macromolecules has been one of the goals of theoretical chemistry for a long time, and in this context, several linear scaling techniques have been successfully devised over th ...

AMER CHEMICAL SOC2018

Parasitic Oscillations in Smooth-Wall Circular Symmetric Gyrotron Beam Ducts

Stefano Alberti, Jérémy Genoud, Minh Quang Tran, Jean-Philippe Hogge, Trach-Minh Tran, Konstantinos Avramidis

In order to study parasitic oscillation that may occur in a realistic beam duct upstream to the gyrotron cavity, the self-consistent linear and spectral code TWANGlinspec has been modified. The large inhomogeneities in the smooth-wall beam duct geometry or ...

2018

How Do London Dispersion Interactions Impact the Photochemical Processes of Molecular Switches?

Anne-Clémence Corminboeuf, Alberto Fabrizio

In the last two decades, linear-response time-dependent density functional theory (LR-TDDFT) has become one of the most widely used approaches for the computation of the excited-state properties of atoms and molecules. Despite its success in describing the ...

2018

Origin of the Strong Interaction between Polar Molecules and Copper(II) Paddle-Wheels in Metal Organic Frameworks

Berend Smit, Daniele Ongari, Davide Tiana

The copper paddle-wheel is the building unit of many metal organic frameworks. Because of the ability of the copper cations to attract polar molecules, copper paddle-wheels are promising for carbon dioxide adsorption and separation. They have therefore bee ...

American Chemical Society2017

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Emiliano Fable

Dahye Choi

Ben McMillan

Kevin Henricus Annemarie Verhaegh

Dávid Wágner

Thomas Binderup Jensen

In ASDEX Upgrade, the propagation of cold pulses induced by type-I edge localized modes (ELMs) is studied using electron cyclotron emission measurements, in a dataset of plasmas with moderate triangularity. It is found that the edge safety factor or the pl ...

2019