activity
20182021
most citedOctopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

415 citations · 789 across the 6 of their papers we have counts for

collaborators

8 papers

cond-mat.mtrl-sci2021★ 108 cited

The Ferroelectric Photo-Groundstate of SrTiO: Cavity Materials Engineering

Simone Latini, Dongbin Shin, Shunsuke A. Sato +4

Optical cavities confine light on a small region in space which can result in a strong coupling of light with materials inside the cavity. This gives rise to new states where quant…

cond-mat.mtrl-sci2021★ 48 cited

The quantum paraelectric phase of SrTiO from first principles

Dongbin Shin, Simone Latini, Christian Schäfer +4

We demonstrate how the quantum paraelectric ground state of SrTiO can be accessed via a microscopic approach based on density functional theory. At low temperature…

physics.chem-ph2020★ 146 cited

Intermolecular interactions in optical cavities: an ab initio QED study

Tor S. Haugland, Christian Schäfer, Enrico Ronca +2

Intermolecular bonds are weak compared to covalent bonds, but they are strong enough to influence the properties of large molecular systems. In this work, we investigate how strong…

cond-mat.mes-hall2020

Polaritonic Chemistry: Collective Strong Coupling Implies Strong Local Modification of Chemical Properties

Dominik Sidler, Christian Schäfer, Michael Ruggenthaler +1

Polaritonic chemistry has become a rapidly developing field within the last few years. A multitude of experimental observations suggest that chemical properties can be fundamentall…

physics.comp-ph2019★ 415 cited

Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

Nicolas Tancogne-Dejean, Micael J. T. Oliveira, Xavier Andrade +31

Over the last years extraordinary advances in experimental and theoretical tools have allowed us to monitor and control matter at short time and atomic scales with a high-degree of…

quant-ph2019★ 62 cited

Benchmarking Semiclassical and Perturbative Methods for Real-time Simulations of Cavity-Bound Emission and Interference

Norah M. Hoffmann, Christian Schäfer, Niko Säkkinen +3

We benchmark a selection of semiclassical and perturbative dynamics techniques by investigating the correlated evolution of a cavity-bound atomic system to assess their applicabili…

quant-ph2019

Relevance of the quadratic diamagnetic and self-polarization terms in cavity quantum electrodynamics

Christian Schäfer, Michael Ruggenthaler, Vasil Rokaj +1

Experiments at the interface of quantum-optics and chemistry have revealed that strong coupling between light and matter can substantially modify chemical and physical properties o…

quant-ph2018★ 10 cited

Dressed-Orbital Approach to Cavity Quantum Electrodynamics and Beyond

S. E. B. Nielsen, C. Schäfer, M. Ruggenthaler +1

We present a novel representation of coupled matter-photon systems that allows the application of many-body methods developed for purely fermionic systems. We do so by rewriting th…