Publications of M. Ruggenthaler

Journal Article (33)

2018
Journal Article
Generalized Kohn–Sham iteration on Banach spaces
A. Laestadius, M. Penz, E. I. Tellgren, M. Ruggenthaler, S. Kvaal, T. Helgaker
The Journal of Chemical Physics 149 (16), 164103 (2018)
Journal Article
Numerical construction of the density-potential mapping
European Physical Journal B 91 (10), 235 (2018)
Journal Article
Ab initio nonrelativistic quantum electrodynamics: Bridging quantum chemistry and quantum optics from weak to strong coupling
Physical Review A 98, 043801 (2018)
Journal Article
Kinetic-Energy Density-Functional Theory on a Lattice
Journal of Chemical Theory and Computation 14 (8), 4072–4087 (2018)
Journal Article
From a quantum-electrodynamical light–matter description to novel spectroscopies
Nature Reviews Chemistry 2 (3), UNSP 0118 (2018)
Journal Article
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)
Journal Article
Light–matter interaction in the long-wavelength limit: no ground-state without dipole self-energy
Journal of Physics B: Atomic, Molecular and Optical Physics 51 (3), 034005 (2018)
2017
Journal Article
Exact functionals for correlated electron-photon systems
New Journal of Physics 19, 113036 (2017)
Journal Article
[Viewpoint:] Inducing Multiple Reactions with a Single Photon
Physics 10, 105 (2017)
Journal Article
Atoms and molecules in cavities, from weak to strong coupling in quantum-electrodynamics (QED) chemistry
Proceedings of the National Academy of Sciences of the United States of America 114 (12), 3026–3034 (2017)
Journal Article
Cavity Born-Oppenheimer Approximation for Correlated Electron-Nuclear-Photon Systems
Journal of Chemical Theory and Computation 13 (4), 1616–1625 (2017)
2016
Journal Article
Time-dependent density functional theory beyond Kohn–Sham Slater determinants
J. I. Fuks, S. E. B. Nielsen, M. Ruggenthaler, N. T. Maitra
Physical Chemistry Chemical Physics 18 (31), 20976–20985 (2016)
2015
Journal Article
Kohn–Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space
Proceedings of the National Academy of Sciences of the United States of America 112 (50), 15285–15290 (2015)

Working Paper (5)

2021
Working Paper
A perspective on ab initio modeling of polaritonic chemistry: The role of non-equilibrium effects and quantum collectivity
(2021)
Working Paper
Making ab initio QED functional(s): Non-perturbative and photon-free effective frameworks for strong light-matter coupling
(2021)
2020
Working Paper
The Free Electron Gas in Cavity Quantum Electrodynamics
(2020)
2018
Working Paper
Dressed-Orbital Approach to Cavity Quantum Electrodynamics and Beyond
(2018)
2017
Working Paper
Ground-State Quantum-Electrodynamical Density-Functional Theory
(2017)
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