Image de couverture de livre

Combining Effective Hamiltonians and Brillouin-Wigner Approach: A Perturbative Approach to Spectroscopy

Fuente: arXiv

Enregistré dans:

Détails bibliographiques
Auteurs principaux:	Bindech, Oussama, Valentin, Bastien, Yalouz, Saad, Robert, Vincent
Format:	Preprint
Publié:	2024
Sujets:	Chemical Physics
Accès en ligne:	Acceder al recurso
Tags:	Ajouter un tag Pas de tags, Soyez le premier à ajouter un tag!

Documents similaires

A State-Specific Iterative Decoupling Scheme Based on Perturbation Theory for Low-Energy Electronic States
par: Bindech, Oussama, et autres
Publié: (2025)

Orthogonally Constrained CASSCF Framework: Newton-Raphson Orbital Optimization and Nuclear Gradients
par: Delafosse, Loris, et autres
Publié: (2026)

Fragment quantum embedding using the Householder transformation: a multi-state extension based on ensembles
par: Cernatic, Filip, et autres
Publié: (2024)

Transformation-free generation of a quasi-diabatic representation from the state-average orbital-optimized variational quantum eigensolver
par: Illésová, Silvie, et autres
Publié: (2025)

Chemical Potentials and the One-Electron Hamiltonian of the Second-Order Perturbation Theory from the Functional Derivative Approach
par: Li, Jiachen, et autres
Publié: (2024)

Multireference Perturbation Theories Based on the Dyall Hamiltonian
par: Sokolov, Alexander Yu.
Publié: (2024)

A Perturbative Super-CI Approach for orbital optimization in Two-Component relativistic CASSCF
par: Guo, Yang, et autres
Publié: (2026)

Combination of the Perturbation Theory with Configuration Interaction Method
par: Kozlov, M. G., et autres
Publié: (2022)

Density Matrix Renormalization Group Approach Based on the Coupled-Cluster Downfolded Hamiltonians
par: Bauman, Nicholas, et autres
Publié: (2024)

Effective Hamiltonian based DNP Sequence Optimization
par: Niccoli, Lorenzo, et autres
Publié: (2026)

Semiclassical Dynamics in Wigner Phase Space II : nonadiabatic Hybrid Wigner Dynamics
par: Malpathak, Shreyas, et autres
Publié: (2024)

Semiclassical Dynamics in Wigner Phase Space I : Adiabatic Hybrid Wigner Dynamics
par: Malpathak, Shreyas, et autres
Publié: (2024)

Effective Hamiltonians from Spin Adapted Configuration Interaction
par: Safari, Arta A., et autres
Publié: (2024)

Density-Matrix Embedding Based Multi-Configurational Perturbation Theory Approach to Single-Ion Magnets
par: Guan, Zhe-Bin, et autres
Publié: (2025)

N-Mode Quantized Anharmonic Vibronic Hamiltonians for Matrix Product State Dynamics
par: Barandun, Valentin, et autres
Publié: (2025)

Light-Induced Quantum Self-Trapping of Vibrational Excitons in an Optical Cavity
par: Pouthier, Vincent, et autres
Publié: (2026)

Efficient Composite Infrared Spectroscopy: Combining the Doubly-Harmonic Approximation with Machine Learning Potentials
par: Pracht, Philipp, et autres
Publié: (2024)

Defect-Mediated Pairing and Dissociation of Strongly Correlated Electrons in Low Dimensional Lattices: The Quantum Taxi Effect
par: Pouthier, Vincent, et autres
Publié: (2025)

Influence Functional Approach to Non-Perturbative Exciton Binding Renormalization from Phonons
par: Rana, Rohit, et autres
Publié: (2026)

Wavepacket and Reduced-Density Approaches for High-Dimensional Quantum Dynamics: Application to the Nonlinear Spectroscopy of Asymmetrical Light-Harvesting Building Blocks
par: Galiana, Joachim, et autres
Publié: (2024)

Majorana Tensor Decomposition: A unifying framework for decompositions of fermionic Hamiltonians to Linear Combination of Unitaries
par: Loaiza, Ignacio, et autres
Publié: (2024)

DMRG/FQ: a Polarizable Embedding Approach Combining Density Matrix Renormalization Group and Fluctuating Charges
par: Rinaldi, Matteo, et autres
Publié: (2026)

Resource-efficient Quantum Algorithms for Selected Hamiltonian Subspace Diagonalization
par: Graves, Vincent, et autres
Publié: (2026)

Efficient Simulation of Non-Markovian Path Integrals via Imaginary Time Evolution of an Effective Hamiltonian
par: Yang, Xiaoyu, et autres
Publié: (2026)

A Phase Space Approach to Vibrational Circular Dichroism
par: Duston, Titouan, et autres
Publié: (2024)

Semiclassical Approach to Photophysics Beyond Kasha's Rule and Vibronic Spectroscopy Beyond the Condon Approximation. The Case of Azulene
par: Prlj, Antonio, et autres
Publié: (2020)

Post-collision interaction in the liquid phase: the role of electron scattering
par: Dupuy, Rémi, et autres
Publié: (2025)

Beyond Cavity Born-Oppenheimer: On Non-Adiabatic Coupling and Effective Ground State Hamiltonians in Vibro-Polaritonic Chemistry
par: Fischer, Eric W., et autres
Publié: (2023)

Controlling Effective Hamiltonians: Broadband Pulsed Dynamic Nuclear Polarization by Constrained Random Walk and Non-linear Optimization
par: Nielsen, Anders B., et autres
Publié: (2025)

Anisotropic Molecular Photoemission Dynamics Part. I Wigner meets the RABBIT
par: M., Berkane, et autres
Publié: (2023)

Efficient Implementation of Relativistic Coupled Cluster Linear Response Theory in Combination with Perturbation Sensitive Natural Spinors and Cholesky Decomposition Treatment of Two-electron Integrals
par: Chakraborty, Sudipta, et autres
Publié: (2026)

Practical Phase-Space Electronic Hamiltonians for Ab Initio Dynamics
par: Tao, Zhen, et autres
Publié: (2024)

Polarisation, Born Effective Charges, and Topological Invariants via a Berry-Phase Approach
par: Carbogno, Christian, et autres
Publié: (2025)

Plasmon Enhanced Spectroscopy and Photocatalysis
par: Giri, Sajal Kumar, et autres
Publié: (2024)

Enhancing Peak Assignment in 13C NMR Spectroscopy: A Novel Approach Using Multimodal Alignment
par: Xu, Hao, et autres
Publié: (2023)

Reverse Intersystem Crossing Dynamics in Vibronically Modulated Inverted Singlet-Triplet Gap System: A Wigner Phase Space Study
par: Karak, Pijush, et autres
Publié: (2024)

An Analysis of the Mapping Approach to Surface Hopping
par: Vavřín, Jan
Publié: (2025)

Symmetry Breaking as Predicted by a Phase Space Hamiltonian with a Spin Coriolis Potential
par: Bradbury, Nadine C., et autres
Publié: (2025)

Hyperfine-Resolved Rotational Spectroscopy of HCNH+
par: Silva, Weslley G. D. P., et autres
Publié: (2024)

Lineshapes in Pump-Probe Spectroscopy of Polaritons
par: Philipp, Luca Nils, et autres
Publié: (2025)