Saved in:
| Main Authors: | Hou, Bowen, Wu, Jinyuan, Qiu, Diana Y. |
|---|---|
| Format: | Preprint |
| Published: |
2024
|
| Subjects: | |
| Online Access: | https://arxiv.org/abs/2404.14601 |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Similar Items
MBFormer: A General Transformer-based Learning Paradigm for Many-body Interactions in Real Materials
by: Hou, Bowen, et al.
Published: (2025)
by: Hou, Bowen, et al.
Published: (2025)
Universal Machine Learning Kohn-Sham Hamiltonian for Materials
by: Zhong, Yang, et al.
Published: (2024)
by: Zhong, Yang, et al.
Published: (2024)
Direct Observation of Massless Excitons and Linear Exciton Dispersion
by: Liu, Luna Y., et al.
Published: (2025)
by: Liu, Luna Y., et al.
Published: (2025)
Excited-State-Specific Kohn-Sham Formalism for the Asymmetric Hubbard Dimer
by: Loos, Pierre-François, et al.
Published: (2024)
by: Loos, Pierre-François, et al.
Published: (2024)
Enhancing the Scalability and Applicability of Kohn-Sham Hamiltonians for Molecular Systems
by: Li, Yunyang, et al.
Published: (2025)
by: Li, Yunyang, et al.
Published: (2025)
Accurate and efficient simulation of photoemission spectroscopy via Kohn-Sham scattering states
by: Parusa, Gian, et al.
Published: (2026)
by: Parusa, Gian, et al.
Published: (2026)
Generalized Kohn-Sham Approach for the Electronic Band Structure of Spin-Orbit Coupled Materials
by: Desmarais, Jacques K., et al.
Published: (2023)
by: Desmarais, Jacques K., et al.
Published: (2023)
Efficient plane-wave approach to generalized Kohn-Sham density-functional theory of solids with mixed deterministic/stochastic exchange
by: Allen, Tucker, et al.
Published: (2025)
by: Allen, Tucker, et al.
Published: (2025)
Kohn-Sham-Proca equations for ultrafast exciton dynamics
by: Dewhurst, J. K., et al.
Published: (2024)
by: Dewhurst, J. K., et al.
Published: (2024)
Kohn-Sham Hamiltonian from Effective Field Theory: Quasiparticle Band Narrowing from Frozen Core Dynamics
by: Cai, Xiansheng, et al.
Published: (2026)
by: Cai, Xiansheng, et al.
Published: (2026)
Optical absorption spectroscopy probes water wire and its ordering in a hydrogen-bond network
by: Tang, Fujie, et al.
Published: (2024)
by: Tang, Fujie, et al.
Published: (2024)
Quantum Many-Body Simulations of Catalytic Metal Surfaces
by: Cao, Changsu, et al.
Published: (2025)
by: Cao, Changsu, et al.
Published: (2025)
Unified Deep Learning Framework for Many-Body Quantum Chemistry via Green's Functions
by: Venturella, Christian, et al.
Published: (2024)
by: Venturella, Christian, et al.
Published: (2024)
Perturbing finite temperature multicomponent DFT 1D Kohn-Sham systems: Peierls Gap & Kohn Anomaly
by: Scheppe, Adrian D., et al.
Published: (2025)
by: Scheppe, Adrian D., et al.
Published: (2025)
Renormalization of States and Quasiparticles in Many-body Downfolding
by: Canestraight, Annabelle, et al.
Published: (2024)
by: Canestraight, Annabelle, et al.
Published: (2024)
Fractionalized Kohn-Sham Scheme for Strongly Correlated Electrons
by: Zhao, Bo, et al.
Published: (2024)
by: Zhao, Bo, et al.
Published: (2024)
Identifying strong correlation using only the Kohn-Sham density of one-electron states
by: Rivera, Daniel D., et al.
Published: (2026)
by: Rivera, Daniel D., et al.
Published: (2026)
Electric Polarization from Many-Body Neural Network Ansatz
by: Li, Xiang, et al.
Published: (2023)
by: Li, Xiang, et al.
Published: (2023)
Electronic excitation spectra of molecular hydrogen in Phase I from Quantum Monte Carlo and Many-Body perturbation methods
by: Gorelov, Vitaly, et al.
Published: (2023)
by: Gorelov, Vitaly, et al.
Published: (2023)
A Hierarchical Approach to Quantum Many-Body Systems in Structured Environments
by: Müller, Kai, et al.
Published: (2024)
by: Müller, Kai, et al.
Published: (2024)
Integrating Graph Neural Networks and Many-Body Expansion Theory for Potential Energy Surfaces
by: Chen, Siqi, et al.
Published: (2024)
by: Chen, Siqi, et al.
Published: (2024)
Density of States Calculation of CeO$_2$ Based on VASP
by: Hou, Ruyi
Published: (2025)
by: Hou, Ruyi
Published: (2025)
What is the signature of a trion in photoemission?
by: Wu, Jinyuan, et al.
Published: (2025)
by: Wu, Jinyuan, et al.
Published: (2025)
Benchmarking Universal Machine Learning Interatomic Potentials for Real-Time Analysis of Inelastic Neutron Scattering Data
by: Han, Bowen, et al.
Published: (2025)
by: Han, Bowen, et al.
Published: (2025)
Prediction of Superionic State in LiH2 at Conditions Enroute to Nuclear Fusion
by: Li, Fude, et al.
Published: (2024)
by: Li, Fude, et al.
Published: (2024)
Effect of cation-disorder on lithium transport in halide superionic conductors
by: Zhong, Peichen, et al.
Published: (2024)
by: Zhong, Peichen, et al.
Published: (2024)
Inverting the Kohn-Sham equations with physics-informed machine learning
by: Martinetto, Vincent, et al.
Published: (2023)
by: Martinetto, Vincent, et al.
Published: (2023)
Data-driven Low-rank Approximation for Electron-hole Kernel and Acceleration of Time-dependent GW Calculations
by: Hou, Bowen, et al.
Published: (2025)
by: Hou, Bowen, et al.
Published: (2025)
Tucker tensor approach for accelerating exchange computations in a real-space finite-element discretization of generalized Kohn-Sham density functional theory
by: Subramanian, Vishal, et al.
Published: (2024)
by: Subramanian, Vishal, et al.
Published: (2024)
Effect of Concentration Fluctuations on Material Properties of Disordered Alloys
by: Liang, Han-Pu, et al.
Published: (2025)
by: Liang, Han-Pu, et al.
Published: (2025)
Kohn-Sham inversion with mathematical guarantees
by: Herbst, Michael F., et al.
Published: (2024)
by: Herbst, Michael F., et al.
Published: (2024)
Advancing Surface Chemistry with Large-Scale Ab-Initio Quantum Many-Body Simulations
by: Huang, Zigeng, et al.
Published: (2024)
by: Huang, Zigeng, et al.
Published: (2024)
Intertwined Hyperferroelectricity, Tunable Multiple Topological Phases and Giant Rashba Effect in Wurtzite LiZnAs
by: Patel, Saurav, et al.
Published: (2025)
by: Patel, Saurav, et al.
Published: (2025)
Excitonic effects in phonons: reshaping the graphene Kohn anomalies and lifetimes
by: Guandalini, Alberto, et al.
Published: (2025)
by: Guandalini, Alberto, et al.
Published: (2025)
Note: Bridging Information Science: AB Initio Calculation Vortex of 2D Materials of Bismuthene(Bismuth Molecule) Graphene-Shaped through Kohn-Sham Equations
by: Kawahata, Yasuko
Published: (2024)
by: Kawahata, Yasuko
Published: (2024)
Convergence of Body-Orders in Linear Atomic Cluster Expansions
by: Tan, Apolinario Miguel, et al.
Published: (2025)
by: Tan, Apolinario Miguel, et al.
Published: (2025)
Unsupervised identification of crystal defects from atomistic potential descriptors
by: Kývala, Lukáš, et al.
Published: (2024)
by: Kývala, Lukáš, et al.
Published: (2024)
Unsupervised learning of representative local atomic arrangements in molecular dynamics data
by: Roncoroni, Fabrice, et al.
Published: (2023)
by: Roncoroni, Fabrice, et al.
Published: (2023)
Many-body perturbation theory vs. density functional theory: A systematic benchmark for band gaps of solids
by: Großmann, Max, et al.
Published: (2025)
by: Großmann, Max, et al.
Published: (2025)
Equivariant Electronic Hamiltonian Prediction with Many-Body Message Passing
by: Qian, Chen, et al.
Published: (2025)
by: Qian, Chen, et al.
Published: (2025)
Similar Items
-
MBFormer: A General Transformer-based Learning Paradigm for Many-body Interactions in Real Materials
by: Hou, Bowen, et al.
Published: (2025) -
Universal Machine Learning Kohn-Sham Hamiltonian for Materials
by: Zhong, Yang, et al.
Published: (2024) -
Direct Observation of Massless Excitons and Linear Exciton Dispersion
by: Liu, Luna Y., et al.
Published: (2025) -
Excited-State-Specific Kohn-Sham Formalism for the Asymmetric Hubbard Dimer
by: Loos, Pierre-François, et al.
Published: (2024) -
Enhancing the Scalability and Applicability of Kohn-Sham Hamiltonians for Molecular Systems
by: Li, Yunyang, et al.
Published: (2025)