Cover Image

Unraveling vibronic interactions in molecules functionalized with optical cycling centers

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Wojcik, Pawel, Zhou, Haowen, Khvorost, Taras, Zhu, Guo-Zhu, Lao, Guanming, Caram, Justin R., Alexandrova, Anastassia N., Hudson, Eric R., Campbell, Wesley C., Krylov, Anna I.
Format:	Preprint
Published:	2025
Subjects:	Chemical Physics
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Vibronic coupling limits the use of high-lying electronic states in complex molecules for laser cooling
by: Zhou, Haowen, et al.
Published: (2025)

Bottom-up approach to scalable growth of molecules capable of optical cycling
by: Lao, Guanming, et al.
Published: (2024)

Stochastic Metholodgy Shows Molecular Interactions Protect 2D Polaritons
by: Bradbury, Nadine, et al.
Published: (2023)

2500 vibronic eigenstates of the NO$_3$ radical
by: Larsson, Henrik R., et al.
Published: (2024)

Theory of vibronic adsorbate-surface Fano resonances
by: Martinez-Gomez, Luis, et al.
Published: (2024)

Nonadiabatic derivative couplings through multiple Franck-Condon modes dictate the energy gap law for near and short-wave infrared dye molecules
by: Ramos, Pablo, et al.
Published: (2023)

Simulating Exciton Transport with Complex Absorbing Potentials
by: Bazile, Dimitri, et al.
Published: (2026)

Four center integrals for Coulomb interactions in small molecules
by: Goldstein, Garry
Published: (2024)

No more gap-shifting: Stochastic many-body-theory based TDHF for accurate theory of polymethine cyanine dyes
by: Bradbury, Nadine C., et al.
Published: (2024)

Extended Lagrangian molecular dynamics on vibronic surfaces in the nuclear-electronic orbital framework
by: Dickinson, Joseph A., et al.
Published: (2026)

Effect of vibronic relaxation in fluorescence resonance energy transfer: An exact analytical solution
by: Mondal, Sangita, et al.
Published: (2021)

Ion Trap Geometry
by: Krylov, Evgeny V
Published: (2025)

Parameterized Attenuated Exchange for Generalized TDHF@$v_W$ Applications
by: Li, Barry Y., et al.
Published: (2025)

Self-interaction corrected SCAN functional for molecules and solids in the numeric atom-center orbital framework
by: Bi, Sheng, et al.
Published: (2024)

Single vibronic level fluorescence spectra from Hagedorn wavepacket dynamics
by: Zhang, Zhan Tong, et al.
Published: (2024)

Aperiodic defects in periodic solids
by: Lavroff, Robert H., et al.
Published: (2024)

Inverse optically-induced ring currents in ring-shaped molecules
by: Nandipati, Krishna Reddy, et al.
Published: (2024)

On-the-fly ab initio semiclassical evaluation of vibronic spectra at finite temperature
by: Begušić, Tomislav, et al.
Published: (2020)

Making molecules by mergoassociation: the role of center-of-mass motion
by: Bird, Robert C., et al.
Published: (2024)

Finite-temperature vibronic spectra from the split-operator coherence thermofield dynamics
by: Zhang, Zhan Tong, et al.
Published: (2023)

High-pressure Ion Trap
by: Krylov, Evgeny V.
Published: (2025)

Bridging chemistry and Gaussian boson sampling: A photonic hierarchy of approximations for molecular vibronic spectra
by: Eickmann, Jan-Lucas, et al.
Published: (2025)

Equation-of-motion Coupled-cluster singles, doubles and(full) triples for doubly ionized and two-electron-attached states: A Computational implementation
by: Manisha, et al.
Published: (2025)

Broadband impulsive stimulated Raman spectroscopy reveals electronic state-specific vibronic coupling and vibrational coherence transfer through nonadiabatic electronic coupling
by: Kaur, Ramandeep, et al.
Published: (2026)

Capturing anharmonic effects in single vibronic level fluorescence spectra using local harmonic Hagedorn wavepacket dynamics
by: Zhang, Zhan Tong, et al.
Published: (2024)

Unravelling the unique kinetic interactions between N2O and unsaturated hydrocarbons
by: Wu, Hongqing, et al.
Published: (2025)

Multidimensional tunnelling of molecules aligned by strong electric fields
by: Geuther, J. Amira, et al.
Published: (2025)

A quantum chemistry dataset containing ground-state and conical-intersection structures of 260k molecules
by: Zhang, Jiahui, et al.
Published: (2026)

Approximation of the electronic terms of diatomic molecules by the Morse function. The role of anharmonicity. II. Simple terms
by: Denisov, G. S., et al.
Published: (2024)

Coupled cluster theory for positron binding in anions and polyatomic molecules
by: Riso, Rosario R., et al.
Published: (2026)

Observation of sequential three-body dissociation of camphor molecule -- a native frame approach
by: De, S., et al.
Published: (2024)

Why are diffuse atomic orbitals needed for accurate electronic wave functions of even neutral molecules?
by: Powell, Samuel R., et al.
Published: (2025)

Configuration-interaction calculations with density-functional theory molecular orbitals for modeling valence- and core-excited states in molecules
by: Visentin, Giorgio, et al.
Published: (2025)

Cogwheel phase cycling in population-detected optical coherent multidimensional spectroscopy
by: Jayachandran, Ajay, et al.
Published: (2024)

X-ray diffraction from chiral molecules with twisted beams
by: Venkatesh, Akilesh, et al.
Published: (2026)

Energy shifts in predissociating levels of diatomic molecules: The case of N$_2$ (C$''^5Π_u$) and N$_2$(1$^7Σ^+_u$) interacting states
by: Ventura, Laiz R., et al.
Published: (2025)

Axion-mediated electron-nucleus and electron-electron interactions in barium monofluoride molecule
by: Prosnyak, Sergey D., et al.
Published: (2024)

State- and molecule-selective rotational control in gas mixtures with a shaped optical centrifuge
by: Amani, P., et al.
Published: (2021)

Disorder-induced non-Gaussian states in large ensembles of cavity-coupled molecules
by: Schwengelbeck, R., et al.
Published: (2026)

Predicting the binding of small molecules to proteins through invariant representation of the molecular structure
by: Beccaria, R., et al.
Published: (2024)