Excited-State-Specific Kohn-Sham Formalism for the Asymmetric Hubbard Dimer
Fuente:
arXiv
Guardado en:
| Autores principales: | Loos, Pierre-François, Giarrusso, Sara |
|---|---|
| Formato: | Preprint |
| Publicado: |
2024
|
| Materias: | |
| Acceso en línea: | |
| Etiquetas: |
Agregar Etiqueta
Sin Etiquetas, Sea el primero en etiquetar este registro!
|
Ejemplares similares
Exact Excited-State Functionals of the Asymmetric Hubbard Dimer
por: Giarrusso, Sara, et al.
Publicado: (2023)
por: Giarrusso, Sara, et al.
Publicado: (2023)
Excited States of the Uniform Electron Gas
por: Loos, Pierre-François
Publicado: (2025)
por: Loos, Pierre-François
Publicado: (2025)
Parquet theory for molecular systems: Formalism and static kernel parquet approximation
por: Marie, Antoine, et al.
Publicado: (2025)
por: Marie, Antoine, et al.
Publicado: (2025)
From Full Dynamic to Pure Static: A Family of $GW$-Based Approximations
por: Loos, Pierre-François, et al.
Publicado: (2026)
por: Loos, Pierre-François, et al.
Publicado: (2026)
Cumulant Green's function methods for molecules
por: Loos, Pierre-François, et al.
Publicado: (2024)
por: Loos, Pierre-François, et al.
Publicado: (2024)
Anomalous propagators and the particle-particle channel: Hedin's equations
por: Marie, Antoine, et al.
Publicado: (2024)
por: Marie, Antoine, et al.
Publicado: (2024)
Complex Absorbing Potential Green's Function Methods for Resonances
por: Burth, Loris, et al.
Publicado: (2025)
por: Burth, Loris, et al.
Publicado: (2025)
The three channels of many-body perturbation theory: $GW$, particle-particle, and electron-hole $T$-matrix self-energies
por: Orlando, Roberto, et al.
Publicado: (2023)
por: Orlando, Roberto, et al.
Publicado: (2023)
Analytic $G_0W_0$ gradients based on a double-similarity transformation equation-of-motion coupled-cluster treatment
por: Kitsaras, Marios-Petros, et al.
Publicado: (2025)
por: Kitsaras, Marios-Petros, et al.
Publicado: (2025)
Compactification of Determinant Expansions via Transcorrelation
por: Ammar, Abdallah, et al.
Publicado: (2024)
por: Ammar, Abdallah, et al.
Publicado: (2024)
Reference Energies for Double Excitations: Improvement and Extension
por: Kossoski, Fábris, et al.
Publicado: (2024)
por: Kossoski, Fábris, et al.
Publicado: (2024)
The $GW$ Approximation: A Quantum Chemistry Perspective
por: Marie, Antoine, et al.
Publicado: (2023)
por: Marie, Antoine, et al.
Publicado: (2023)
Can $GW$ Handle Multireference Systems?
por: Ammar, Abdallah, et al.
Publicado: (2024)
por: Ammar, Abdallah, et al.
Publicado: (2024)
Modelling the Kohn-Sham potential for molecular dissociation with orbital-independent functionals: a proof of principle
por: Giarrusso, Sara, et al.
Publicado: (2024)
por: Giarrusso, Sara, et al.
Publicado: (2024)
The QUEST Database of Highly-Accurate Excitation Energies
por: Loos, Pierre-François, et al.
Publicado: (2025)
por: Loos, Pierre-François, et al.
Publicado: (2025)
Go Green: Selected Configuration Interaction as a More Sustainable Alternative for High Accuracy
por: Loos, Pierre-François, et al.
Publicado: (2024)
por: Loos, Pierre-François, et al.
Publicado: (2024)
State-Specific Coupled-Cluster Methods for Excited States
por: Damour, Yann, et al.
Publicado: (2024)
por: Damour, Yann, et al.
Publicado: (2024)
Non-hermitian Green's function theory with $N$-body interactions: the coupled-cluster similarity transformation
por: Coveney, Christopher J. N., et al.
Publicado: (2025)
por: Coveney, Christopher J. N., et al.
Publicado: (2025)
Reference Vertical Excitation Energies for Transition Metal Compounds
por: Jacquemin, Denis, et al.
Publicado: (2023)
por: Jacquemin, Denis, et al.
Publicado: (2023)
Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/$GW$ and Wave Function Methods
por: Knysh, Iryna, et al.
Publicado: (2024)
por: Knysh, Iryna, et al.
Publicado: (2024)
Seniority and Hierarchy Configuration Interaction for Radicals and Excited States
por: Kossoski, Fábris, et al.
Publicado: (2023)
por: Kossoski, Fábris, et al.
Publicado: (2023)
Degenerate coupled-cluster theory
por: Hirata, So
Publicado: (2026)
por: Hirata, So
Publicado: (2026)
Neutral electronic excitations and derivative discontinuities: An extended $N$-centered ensemble density functional theory perspective
por: Cernatic, Filip, et al.
Publicado: (2024)
por: Cernatic, Filip, et al.
Publicado: (2024)
Connections between Richardson-Gaudin States, Perfect-Pairing, and Pair Coupled-Cluster Theory
por: Johnson, Paul A., et al.
Publicado: (2025)
por: Johnson, Paul A., et al.
Publicado: (2025)
Benchmarking total energies with Hund's J terms in Hubbard-corrected spin-crossover chemistry
por: MacEnulty, Lórien, et al.
Publicado: (2025)
por: MacEnulty, Lórien, et al.
Publicado: (2025)
Multichannel Dyson equation: derivation and analysis
por: Riva, Gabriele, et al.
Publicado: (2024)
por: Riva, Gabriele, et al.
Publicado: (2024)
Identifying strong correlation using only the Kohn-Sham density of one-electron states
por: Rivera, Daniel D., et al.
Publicado: (2026)
por: Rivera, Daniel D., et al.
Publicado: (2026)
Reference Energies for Valence Ionizations and Satellite Transitions
por: Marie, Antoine, et al.
Publicado: (2024)
por: Marie, Antoine, et al.
Publicado: (2024)
Dimer in the Hubbard model. Exact and approximate solutions
por: Mironov, Gennadiy Ivanovich
Publicado: (2025)
por: Mironov, Gennadiy Ivanovich
Publicado: (2025)
Facilities and practices for linear response Hubbard parameters U and J in Abinit
por: MacEnulty, Lórien, et al.
Publicado: (2024)
por: MacEnulty, Lórien, et al.
Publicado: (2024)
Core-level signature of long-range density-wave order and short-range excitonic correlations probed by attosecond broadband spectroscopy
por: Zong, Alfred, et al.
Publicado: (2024)
por: Zong, Alfred, et al.
Publicado: (2024)
Electronic Correlations in Multiferroic van der Waals CuCrP$_2$S6: Insights From X-Ray Spectroscopy and DFT
por: Guo, Yefei, et al.
Publicado: (2024)
por: Guo, Yefei, et al.
Publicado: (2024)
Aperiodic defects in periodic solids
por: Lavroff, Robert H., et al.
Publicado: (2024)
por: Lavroff, Robert H., et al.
Publicado: (2024)
Theory of interaction-induced charge order in CrSBr
por: Cui, Zhi-Hao, et al.
Publicado: (2025)
por: Cui, Zhi-Hao, et al.
Publicado: (2025)
Uncovering relationships between the electronic self-energy and coupled-cluster doubles theory
por: Coveney, Christopher J. N.
Publicado: (2025)
por: Coveney, Christopher J. N.
Publicado: (2025)
Hidden Relaxation Term in Approximate Treatments of Responses to Electric and Magnetic Fields
por: Desmarais, Jacques K.
Publicado: (2023)
por: Desmarais, Jacques K.
Publicado: (2023)
Ab Initio Many Body Quantum Embedding and Local Correlation in Crystalline Materials using Interpolative Separable Density Fitting
por: Yang, Junjie, et al.
Publicado: (2026)
por: Yang, Junjie, et al.
Publicado: (2026)
Ab Initio Auxiliary-Field Quantum Monte Carlo in the Thermodynamic Limit
por: Zhang, Jinghong, et al.
Publicado: (2026)
por: Zhang, Jinghong, et al.
Publicado: (2026)
Non-linear and non-empirical double hybrid density functional
por: Khan, Danish
Publicado: (2025)
por: Khan, Danish
Publicado: (2025)
Natural orbitals and two-particle correlators as tools for analysis of effective exchange couplings in solids
por: Pokhilko, Pavel, et al.
Publicado: (2023)
por: Pokhilko, Pavel, et al.
Publicado: (2023)
Ejemplares similares
-
Exact Excited-State Functionals of the Asymmetric Hubbard Dimer
por: Giarrusso, Sara, et al.
Publicado: (2023) -
Excited States of the Uniform Electron Gas
por: Loos, Pierre-François
Publicado: (2025) -
Parquet theory for molecular systems: Formalism and static kernel parquet approximation
por: Marie, Antoine, et al.
Publicado: (2025) -
From Full Dynamic to Pure Static: A Family of $GW$-Based Approximations
por: Loos, Pierre-François, et al.
Publicado: (2026) -
Cumulant Green's function methods for molecules
por: Loos, Pierre-François, et al.
Publicado: (2024)