Publikationen von C. Schäfer
Alle Typen
Zeitschriftenartikel (14)
2022
Zeitschriftenartikel
A perspective on ab initio modeling of polaritonic chemistry: The role of non-equilibrium effects and quantum collectivity
The Journal of Chemical Physics 156 (23), 230901 (2022)
2021
Zeitschriftenartikel
Making ab initio QED functional(s): Nonperturbative and photon-free effective frameworks for strong light–matter coupling
Proceedings of the National Academy of Sciences of the United States of America 118 (41), e2110464118 (2021)
Zeitschriftenartikel
The ferroelectric photo ground state of SrTiO3: Cavity materials engineering
Proceedings of the National Academy of Sciences of the United States of America 118 (31), e2105618118 (2021)
Zeitschriftenartikel
Quantum paraelectric phase of SrTiO3 from first principles
Physical Review B 104 (6), L060103 (2021)
Zeitschriftenartikel
Engineering quantum materials with chiral optical cavities
Nature Materials 20 (4), 438–442 (2021)
Zeitschriftenartikel
Intermolecular interactions in optical cavities: An ab initio QED study
The Journal of Chemical Physics 154 (9), 094113 (2021)
Zeitschriftenartikel
Polaritonic Chemistry: Collective Strong Coupling Implies Strong Local Modification of Chemical Properties
The Journal of Physical Chemistry Letters 12 (1), 508–516 (2021)
2020
Zeitschriftenartikel
Relevance of the Quadratic Diamagnetic and Self-Polarization Terms in Cavity Quantum Electrodynamics
ACS Photonics 7 (4), 975–990 (2020)
Zeitschriftenartikel
Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems
N. Tancogne-Dejean, M. J. T. Oliveira, , H. Appel, , , F. Buchholz, , , , U. de Giovannini, , F. G. Eich, , , , , H. Hübener, R. Jestädt, J. Jornet-Somoza, , , M. Lüders, , , , , , , S. Sato, C. Schäfer, I. Theophilou, , A. Rubio
The Journal of Chemical Physics 152 (12), 124119 (2020)
2019
Zeitschriftenartikel
Benchmarking semiclassical and perturbative methods for real-time simulations of cavity-bound emission and interference
The Journal of Chemical Physics 151 (24), 244113 (2019)
Zeitschriftenartikel
Capturing vacuum fluctuations and photon correlations in cavity quantum electrodynamics with multitrajectory Ehrenfest dynamics
Physical Review A 99 (6), 063819 (2019)
Zeitschriftenartikel
Modification of excitation and charge transfer in cavity quantum-electrodynamical chemistry
Proceedings of the National Academy of Sciences of the United States of America 116 (11), 4883–4892 (2019)
2018
Zeitschriftenartikel
Ab initio nonrelativistic quantum electrodynamics: Bridging quantum chemistry and quantum optics from weak to strong coupling
Physical Review A 98, 043801 (2018)
Zeitschriftenartikel
Ab Initio Optimized Effective Potentials for Real Molecules in Optical Cavities: Photon Contributions to the Molecular Ground State
ACS Photonics 5 (3), 992–1005 (2018)
Poster (1)
2015
Poster
Krieger-Li-Iafrate approximation to the optimized effective potential approach in density functional theory for quantum electrodynamics
Hochschulschrift - Doktorarbeit (1)
2020
Hochschulschrift - Doktorarbeit
On the interface of quantum electrodynamics and electronic structure theory: Cavity QED
Universität Hamburg, 2020
Forschungspapier (3)
2022
Forschungspapier
Simulating terahertz field-induced transient ferroeletricity in quantum paraelectric SrTiO3
(2022)
Forschungspapier
Shining Light on the Microscopic Resonant Mechanism Responsible for Cavity-Mediated Chemical Reactivity
C. Schäfer, , , , A. Rubio
(2022)
2019
Forschungspapier
Dressed-Orbital Approach to Cavity Quantum Electrodynamics and Beyond
(2019)