Copertina

Incorporating quasiparticle and excitonic properties into material discovery

Fuente: arXiv

Salvato in:

Dettagli Bibliografici
Autori principali:	Biswas, Tathagata, Singh, Arunima K.
Natura:	Preprint
Pubblicazione:	2024
Soggetti:	Materials Science
Accesso online:	Acceder al recurso
Tags:	Aggiungi Tag Nessun Tag, puoi essere il primo ad aggiungerne!!

Documenti analoghi

Electronic Properties of Ultra-Wide Bandgap B$_x$Al$_{1-x}$N Computed from First-Principles Simulations
di: Milne, Cody L., et al.
Pubblicazione: (2023)

Electronic Properties of Ultra‐Wide Bandgap BxAl1−xN Computed from First‐Principles Simulations
di: Cody L. Milne, et al.
Pubblicazione: (2024)

Many-body \textit{ab initio} study of quasiparticles, optical excitations, and excitonic properties in LiZnAs and ScAgC for photovoltaic applications
di: Solet, Vinod Kumar, et al.
Pubblicazione: (2025)

First-principles band alignment engineering in polar and nonpolar orientations for wurtzite AlN, GaN, and B$_x$Al$_{1-x}$N alloys
di: Milne, Cody L, et al.
Pubblicazione: (2025)

A tomographic interpretation of structure-property relations for materials discovery
di: Ortega-Ochoa, Raul, et al.
Pubblicazione: (2025)

Predicting the Structure and Stability of Oxide Nanoscrolls from Dichalcogenide Precursors
di: Gupta, Adway, et al.
Pubblicazione: (2024)

Atomistic theory of twist-angle dependent intralayer and interlayer exciton properties in twisted bilayer materials
di: Maity, Indrajit, et al.
Pubblicazione: (2024)

Screening 39 billion protostructures for materials discovery
di: Parackal, Abhijith S, et al.
Pubblicazione: (2026)

Robust and tunable oxide nanoscrolls for solar-driven H$_2$ generation and storage
di: Gupta, Adway, et al.
Pubblicazione: (2025)

Double-Rashba materials for nanocrystals with bright ground-state excitons
di: Swift, Michael W., et al.
Pubblicazione: (2023)

On the mechanical, thermoelectric, and excitonic properties of Tetragraphene monolayer
di: Tromer, Raphael M., et al.
Pubblicazione: (2024)

Fundamental Factors Governing Stabilization of Janus 2D-Bulk Heterostructures with Machine Learning
di: Boland, Tara M., et al.
Pubblicazione: (2025)

Optical materials discovery and design with federated databases and machine learning
di: Trinquet, Victor, et al.
Pubblicazione: (2024)

Are diffusion models ready for materials discovery in unexplored chemical space?
di: Kim, Sanghyun, et al.
Pubblicazione: (2025)

Data-driven active learning approaches for accelerating materials discovery
di: Chen, Jiaxin, et al.
Pubblicazione: (2026)

Origin of trapped intralayer Wannier and charge-transfer excitons in moiré materials
di: Maity, Indrajit, et al.
Pubblicazione: (2025)

Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange
di: Evans, Matthew L., et al.
Pubblicazione: (2024)

Computational discovery of cathode materials for rechargeable aqueous zinc-ion batteries
di: Miliante, Caio Miranda, et al.
Pubblicazione: (2026)

Learning disentangled latent representations facilitates discovery and design of functional materials
di: Cha, Jaehoon, et al.
Pubblicazione: (2025)

The carbon cost of materials discovery: Can machine learning really accelerate the discovery of new photovoltaics?
di: Walker, Matthew, et al.
Pubblicazione: (2025)

Small exciton effective mass in QL Bi2Se2Te: A material platform towards high-temperature excitonic condensate
di: Wang, Yuanyuan, et al.
Pubblicazione: (2024)

Phonon and exciton temperature-dependent properties of twisted MoS$_2$
di: Silva-Santos, Francisco, et al.
Pubblicazione: (2024)

Non-smooth optimization meets automated material model discovery
di: Flaschel, Moritz, et al.
Pubblicazione: (2025)

Brownian electric bubble quasiparticles
di: Aramberri, Hugo, et al.
Pubblicazione: (2023)

Real-time exciton dynamics in two-dimensional materials under ultrashort laser pulses
di: Tumakov, Dmitry, et al.
Pubblicazione: (2026)

Coexistence of Multiple Magnetic Interactions in Oxygen Deficient V2O5 Nanoparticles
di: Sarkar, Tathagata, et al.
Pubblicazione: (2021)

Symmetry-guided data-driven discovery of native quantum defects in two-dimensional materials
di: Tsai, Jeng-Yuan, et al.
Pubblicazione: (2024)

S1-MatAgent: A planner driven multi-agent system for material discovery
di: Wang, Xinrui, et al.
Pubblicazione: (2025)

High-throughput computational screening of Heusler compounds with phonon considerations for enhanced material discovery
di: Xiao, Enda, et al.
Pubblicazione: (2025)

Adaptive AI decision interface for autonomous electronic material discovery
di: Dai, Yahao, et al.
Pubblicazione: (2025)

Coupling between ferroelectric distortions and excitonic properties in PbTiO$_3$
di: Pacchioni, Pietro, et al.
Pubblicazione: (2025)

Unleashing the power of novel conditional generative approaches for new materials discovery
di: Novitskiy, Lev, et al.
Pubblicazione: (2024)

Revealing dark exciton signatures in polariton spectra of 2D materials
di: Ferreira, Beatriz, et al.
Pubblicazione: (2024)

Tunable magneto-optical properties in MoS$_2$ via defect-induced exciton transitions
di: Amit, Tomer, et al.
Pubblicazione: (2022)

Electronic structure and exchange interactions in altermagnetic MnGeP$_2$ in the quasiparticle-self-consistent $GW$ approach
di: Turan, Ilteris K., et al.
Pubblicazione: (2025)

Kohn-Sham-Proca equations for ultrafast exciton dynamics
di: Dewhurst, J. K., et al.
Pubblicazione: (2024)

Accelerating the discovery of high-performance nonlinear optical materials using active learning and high-throughput screening
di: Trinquet, Victor, et al.
Pubblicazione: (2025)

Accelerating discovery of infrared nonlinear optical materials with large shift current via high-throughput screening
di: Yang, Aiqin, et al.
Pubblicazione: (2025)

Spin-dependent quasiparticle lifetimes in altermagnets
di: Leraand, Kristoffer, et al.
Pubblicazione: (2025)

Material Fingerprinting: A shortcut to material model discovery without solving optimization problems
di: Flaschel, Moritz, et al.
Pubblicazione: (2025)