Cover Image

Ab initio study on the dynamics and spectroscopy of collective rovibrational polaritons

Fuente: arXiv

Saved in:

Bibliographic Details
Main Author:	Szidarovszky, Tamás
Format:	Preprint
Published:	2024
Subjects:	Chemical Physics
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Disentangling collective coupling in vibrational polaritons with double quantum coherence spectroscopy
by: Schnappinger, Thomas, et al.
Published: (2024)

Making peace with random phases: Ab initio conical intersection dynamics in random gauges
by: Zhu, Xiaotong, et al.
Published: (2024)

Ab initio study of highly charged ion-induced Coulomb explosion imaging
by: Viveiros, Misa, et al.
Published: (2025)

Ab initio calculations of molecular double Auger decay rates
by: Kolorenč, Přemysl
Published: (2024)

Nonlinear semiclassical spectroscopy of ultrafast molecular polariton dynamics
by: Reitz, Michael, et al.
Published: (2024)

Ab initio surface chemistry with chemical accuracy
by: Ye, Hong-Zhou, et al.
Published: (2023)

Ab initio computation of Auger decay in heavy metals: zinc about it
by: Ferino-Pérez, Anthuan, et al.
Published: (2024)

Ab initio study on photocatalytic properties of PtSSe-WXY Janus heterostructures
by: Shastri, Shivprasad S., et al.
Published: (2025)

Methane dimer rovibrational states and Raman transition moments
by: Daría, Alberto Martín Santa, et al.
Published: (2023)

Regularized Perturbation Theory for Ab initio Solids
by: Chen, Meng-Fu, et al.
Published: (2025)

Ab initio extended Hubbard model of short polyenes for efficient quantum computing
by: Yoshida, Yuichiro, et al.
Published: (2024)

Impact of ligand (OH) deformation on LuOH$^+$ rovibrational spectra
by: Kurchavov, Igor, et al.
Published: (2025)

Ab initio thermodynamics of liquid and solid water
by: Cheng, Bingqing, et al.
Published: (2018)

Ab initio study of electronic states and radiative properties of the AcF molecule
by: Skripnikov, Leonid V., et al.
Published: (2023)

Ab initio intermolecular interactions mediate thermochemically real-fluid effects that affect system reactivity
by: Wang, Mingrui, et al.
Published: (2024)

\emph{Ab initio} derivation of the crystal field parameters for lanthanide ions: The f$^1$ case
by: Sergentu, Dumitru-Claudiu, et al.
Published: (2025)

Ab initio Simulations of EMI-BF4 Neutral-Surface Interactions in Electrospray Thrusters
by: Laws, Nicholas, et al.
Published: (2025)

Two-dimensional IR-Raman spectroscopy of vibrational polaritons: Role of dipole surfaces
by: Ji, Xinwei, et al.
Published: (2026)

Three-states model for calculating the $X$-$X$ rovibrational transition intensities in hydroxyl radical
by: Ushakov, V. G., et al.
Published: (2024)

Quantum dynamics simulation of exciton-polariton transport
by: Krupp, Niclas, et al.
Published: (2024)

Controlling rovibrational state populations of polar molecules in inhomogeneous electric fields of the Stark deceleration: molecular dynamics and quantum chemistry simulations
by: Zak, Emil, et al.
Published: (2025)

Hyperfine rovibrational states of H$_3^+$ in a weak external magnetic field
by: Avila, Gustavo, et al.
Published: (2024)

Ab initio treatment of molecular Coster-Kronig decay using complex-scaled equation-of-motion coupled-cluster theory
by: Drennhaus, Jan Philipp, et al.
Published: (2024)

The ground electronic state of CS: the potential curve and associated Born-Oppenheimer rovibrational spectrum
by: Olivares-Pilon, Horacio, et al.
Published: (2024)

Manifestation of the Normal Intensity Distribution Law (NIDL) in the rovibrational emission spectrum of hydroxyl radical
by: Medvedev, Emile S., et al.
Published: (2024)

Intensities of all fine-structure resolved rovibrational electric quadrupole absorption lines in $^{16}$O$_2$($X^{3}Σ^{-}_{g}$) calculated with a new $\textit{ab initio}$ quadrupole moment curve
by: Gancewski, Maciej, et al.
Published: (2024)

Time-dependent ab__initio molecular-orbital decomposition for high-harmonic generation spectroscopy
by: Marchetta, Marco, et al.
Published: (2025)

Accurate Ab-initio Neural-network Solutions to Large-Scale Electronic Structure Problems
by: Scherbela, Michael, et al.
Published: (2025)

A comprehensive theory for relativistic polaritonic chemistry: a four components ab initio treatment of molecular systems coupled to quantum fields
by: Thiam, Guillaume, et al.
Published: (2024)

Full-dimensional quantum scattering calculations of rovibrationally excited HD+HD collisions
by: Mandal, Bikramaditya, et al.
Published: (2026)

Ab initio machine learning simulation of calcium carbonate from aqueous solutions to the solid state
by: Piaggi, Pablo M., et al.
Published: (2024)

Ab initio relativistic treatment of the intercombination $a^3Π-X^1Σ^+$ Cameron system of the CO molecule
by: Mosyagin, Nikolai S., et al.
Published: (2020)

Non-Hermitian molecular dynamics simulations of exciton-polaritons in lossy cavities
by: Sokolovskii, Ilia, et al.
Published: (2023)

Laser-induced, blackbody-radiation-assisted rovibrational cooling of symmetric-top molecular ions: NH3+ and ND3+
by: Sinha, Archisman, et al.
Published: (2026)

Taylor-mode automatic differentiation for constructing molecular rovibrational Hamiltonian operators
by: Yachmenev, Andrey, et al.
Published: (2025)

Ab initio density functional theory approach to warm dense hydrogen: from density response to electronic correlations
by: Moldabekov, Zhandos A., et al.
Published: (2025)

Ab-initio simulation of excited-state potential energy surfaces with transferable deep quantum Monte Carlo
by: Schätzle, Zeno, et al.
Published: (2025)

Ab initio insights into plasmonic and strong-field contributions to H$_2$ dissociation on silver nanoshells
by: Koval, Natalia E., et al.
Published: (2025)

Variational Lang-Firsov approach plus Møller-Plesset perturbation theory with applications to ab initio polariton chemistry
by: Cui, Zhi-Hao, et al.
Published: (2023)

Multidimensional semiclassical single- and double-quantum spectroscopy of anharmonic molecular polaritons
by: Reitz, Michael, et al.
Published: (2026)