Defect Polaritons from First Principles

DMRG on Top of Plane-Wave Kohn–Sham Orbitals: A Case Study of Defected Boron Nitride

(2021) Gergely Barcza et al.   Journal of Chemical Theory and Computation

Hybridized Defects in Solid-State Materials as Artificial Molecules

(2021) Derek S. Wang et al.   ACS Nano

Light–matter interaction of a molecule in a dissipative cavity from first principles

(2021) Derek S. Wang et al.   JOURNAL OF CHEMICAL PHYSICS

Spin Emitters beyond the Point Dipole Approximation in Nanomagnonic Cavities

(2021) Derek S. Wang et al.   Journal of Physical Chemistry C

Quantum Interfaces to the Nanoscale

(2021) Derek S. Wang et al.   ACS Nano

Cavity quantum electrodynamics design with single photon emitters in hexagonal boron nitride

(2021) Yanan Wang et al.   APPLIED PHYSICS LETTERS

Vacuum Rabi Splitting of a Single Nitrogen-Vacancy Center Coupled to a Photonic Crystal Nanocavity

(2021) Jianyong Yang et al.   INTERNATIONAL JOURNAL OF THEORETICAL PHYSICS

A phononic interface between a superconducting quantum processor and quantum networked spin memories

(2021) Tomáš Neuman et al.   npj Quantum Information

Radiative properties of quantum emitters in boron nitride from excited state calculations and Bayesian analysis

(2021) Shiyuan Gao et al.   npj Computational Materials

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

(2020) Nicolas Tancogne-Dejean et al.   JOURNAL OF CHEMICAL PHYSICS

Molecular polaritons for controlling chemistry with quantum optics

(2020) Felipe Herrera et al.   JOURNAL OF CHEMICAL PHYSICS

Imaging the defect distribution in 2D hexagonal boron nitride by tracing photogenerated electron dynamics

(2020) Keiki Fukumoto et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS

Experimental demonstration of memory-enhanced quantum communication

(2020) M. K. Bhaskar et al.   NATURE

Low-Temperature Electron–Phonon Interaction of Quantum Emitters in Hexagonal Boron Nitride

(2020) Gabriele Grosso et al.   ACS Photonics

Cavity quantum electrodynamics with color centers in diamond

(2020) Erika Janitz et al.   Optica

Ab initio polaritonic potential-energy surfaces for excited-state nanophotonics and polaritonic chemistry

(2020) Johannes Flick et al.   JOURNAL OF CHEMICAL PHYSICS

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

(2020) Dominik Sidler et al.   Journal of Physical Chemistry Letters

Nanomagnonic Cavities for Strong Spin-Magnon Coupling and Magnon-Mediated Spin-Spin Interactions

(2020) Tomáš Neuman et al.   PHYSICAL REVIEW LETTERS

Tilting a ground-state reactivity landscape by vibrational strong coupling

(2019) A. Thomas et al.   SCIENCE

Cavity Control of Excitons in Two-Dimensional Materials

(2019) Simone Latini et al.   NANO LETTERS

Variational Theory of Nonrelativistic Quantum Electrodynamics

(2019) Nicholas Rivera et al.   PHYSICAL REVIEW LETTERS

Spin coherence in two-dimensional materials

(2019) Meng Ye et al.   npj Computational Materials

Cavity Casimir-Polder Forces and Their Effects in Ground-State Chemical Reactivity

(2019) Javier Galego et al.   Physical Review X

Compact Cavity-Enhanced Single-Photon Generation with Hexagonal Boron Nitride

(2019) Tobias Vogl et al.   ACS Photonics

Photonics with hexagonal boron nitride

(2019) Joshua D. Caldwell et al.   Nature Reviews Materials

Tracking Polariton Relaxation with Multiscale Molecular Dynamics Simulations

(2019) Gerrit Groenhof et al.   Journal of Physical Chemistry Letters

Quantum Interference of Electromechanically Stabilized Emitters in Nanophotonic Devices

(2019) B. Machielse et al.   Physical Review X

Carbon dimer defect as a source of the 4.1 eV luminescence in hexagonal boron nitride

(2019) M. Mackoit-Sinkevičienė et al.   APPLIED PHYSICS LETTERS

Light–Matter Response in Nonrelativistic Quantum Electrodynamics

(2019) Johannes Flick et al.   ACS Photonics

Strongly Cavity-Enhanced Spontaneous Emission from Silicon-Vacancy Centers in Diamond

(2018) Jingyuan Linda Zhang et al.   NANO LETTERS

Phonon Networks with Silicon-Vacancy Centers in Diamond Waveguides

(2018) M.-A. Lemonde et al.   PHYSICAL REVIEW LETTERS

Two-dimensional infrared spectroscopy of vibrational polaritons

(2018) Bo Xiang et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Theory for polariton-assisted remote energy transfer

(2018) Matthew Du et al.   Chemical Science

Color Centers in Hexagonal Boron Nitride Monolayers: A Group Theory and Ab Initio Analysis

(2018) Mehdi Abdi et al.   ACS Photonics

Material platforms for spin-based photonic quantum technologies

(2018) Mete Atatüre et al.   Nature Reviews Materials

Atomic-like high-harmonic generation from two-dimensional materials

(2018) Nicolas Tancogne-Dejean et al.   Science Advances

From a quantum-electrodynamical light–matter description to novel spectroscopies

(2018) Michael Ruggenthaler et al.   Nature Reviews Chemistry

Cavity-Correlated Electron-Nuclear Dynamics from First Principles

(2018) Johannes Flick et al.   PHYSICAL REVIEW LETTERS

Energetics and Electronic Structure of Triangular Hexagonal Boron Nitride Nanoflakes

(2018) Mina Maruyama et al.   Scientific Reports

First-principles investigation of quantum emission from hBN defects

(2017) Sherif Abdulkader Tawfik et al.   Nanoscale

Dark Vibronic Polaritons and the Spectroscopy of Organic Microcavities

(2017) Felipe Herrera et al.   PHYSICAL REVIEW LETTERS

Atoms and molecules in cavities, from weak to strong coupling in quantum-electrodynamics (QED) chemistry

(2017) Johannes Flick et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Quantum sensing

(2017) C. L. Degen et al.   REVIEWS OF MODERN PHYSICS

Tunable and high-purity room temperature single-photon emission from atomic defects in hexagonal boron nitride

(2017) Gabriele Grosso et al.   Nature Communications

Scalable fabrication of coupled NV center - photonic crystal cavity systems by self-aligned N ion implantation

(2017) T. Schröder et al.   Optical Materials Express

Exact States and Spectra of Vibrationally Dressed Polaritons

(2017) M. Ahsan Zeb et al.   ACS Photonics

Theory of Nanoscale Organic Cavities: The Essential Role of Vibration-Photon Dressed States

(2017) Felipe Herrera et al.   ACS Photonics

First-principles engineering of charged defects for two-dimensional quantum technologies

(2017) Feng Wu et al.   PHYSICAL REVIEW MATERIALS

Hybrid Light–Matter States in a Molecular and Material Science Perspective

(2016) Thomas W. Ebbesen   ACCOUNTS OF CHEMICAL RESEARCH

Ground-State Chemical Reactivity under Vibrational Coupling to the Vacuum Electromagnetic Field

(2016) Anoop Thomas et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Solid-state single-photon emitters

(2016) Igor Aharonovich et al.   Nature Photonics

Cavity-Controlled Chemistry in Molecular Ensembles

(2016) Felipe Herrera et al.   PHYSICAL REVIEW LETTERS

Suppressing photochemical reactions with quantized light fields

(2016) Javier Galego et al.   Nature Communications

Quantum Emission from Defects in Single-Crystalline Hexagonal Boron Nitride

(2016) Toan Trong Tran et al.   Physical Review Applied

Optimization algorithm for the generation of ONCV pseudopotentials

(2015) Martin Schlipf et al.   COMPUTER PHYSICS COMMUNICATIONS

Ultra-strong coupling of molecular materials: spectroscopy and dynamics

(2015) Jino George et al.   FARADAY DISCUSSIONS

Quantum emission from hexagonal boron nitride monolayers

(2015) Toan Trong Tran et al.   Nature Nanotechnology

Quantum theory of collective strong coupling of molecular vibrations with a microcavity mode

(2015) Javier del Pino et al.   NEW JOURNAL OF PHYSICS

Nanoscale microwave imaging with a single electron spin in diamond

(2015) Patrick Appel et al.   NEW JOURNAL OF PHYSICS

Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems

(2015) Xavier Andrade et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Exciton–polaritons in van der Waals heterostructures embedded in tunable microcavities

(2015) S. Dufferwiel et al.   Nature Communications

Ultra-strong coupling of molecular materials: spectroscopy and dynamics

(2015) Jino George et al.   FARADAY DISCUSSIONS

Cavity-Induced Modifications of Molecular Structure in the Strong-Coupling Regime

(2015) Javier Galego et al.   Physical Review X

XSEDE: Accelerating Scientific Discovery

(2014) John Towns et al.   COMPUTING IN SCIENCE & ENGINEERING

Nanoengineered Diamond Waveguide as a Robust Bright Platform for Nanomagnetometry Using Shallow Nitrogen Vacancy Centers

(2014) S. Ali Momenzadeh et al.   NANO LETTERS

Polariton-mediated energy transfer between organic dyes in a strongly coupled optical microcavity

(2014) David M. Coles et al.   NATURE MATERIALS

Quantum-electrodynamical density-functional theory: Bridging quantum optics and electronic-structure theory

(2014) Michael Ruggenthaler et al.   PHYSICAL REVIEW A

Atom-like crystal defects: From quantum computers to biological sensors

(2014) Lilian Childress et al.   PHYSICS TODAY

Optimized norm-conserving Vanderbilt pseudopotentials

(2013) D. R. Hamann   PHYSICAL REVIEW B

Time-Dependent Density Functional Theory for Many-Electron Systems Interacting with Cavity Photons

(2013) I. V. Tokatly   PHYSICAL REVIEW LETTERS

Strong magnetic coupling of an inhomogeneous nitrogen-vacancy ensemble to a cavity

(2012) K. Sandner et al.   PHYSICAL REVIEW A

Coupling of Nitrogen-Vacancy Centers to Photonic Crystal Cavities in Monocrystalline Diamond

(2012) Andrei Faraon et al.   PHYSICAL REVIEW LETTERS

Enhancement of the zero phonon line emission from a single nitrogen vacancy center in a nanodiamond via coupling to a photonic crystal cavity

(2010) Janik Wolters et al.   APPLIED PHYSICS LETTERS

Deterministic Coupling of a Single Nitrogen Vacancy Center to a Photonic Crystal Cavity

(2010) Dirk Englund et al.   NANO LETTERS

High-Cooperativity Coupling of Electron-Spin Ensembles to Superconducting Cavities

(2010) D. I. Schuster et al.   PHYSICAL REVIEW LETTERS

Defect center room-temperature quantum processors

(2010) J. Wrachtrup   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Quantum computing with defects

(2010) J. R. Weber et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

VESTA: a three-dimensional visualization system for electronic and structural analysis

(2008) Koichi Momma et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Infrared emission of the NV centre in diamond: Zeeman and uniaxial stress studies

(2008) L J Rogers et al.   NEW JOURNAL OF PHYSICS