Imagen de Portada

Panchromatic Absorbing Materials: Molecular Design and Challenges in Photovoltaic Applications

Fuente: arXiv

Guardado en:

Detalles Bibliográficos
Autor principal:	Chou, Hsien-Hsin
Formato:	Preprint
Publicado:	2025
Materias:	Chemical Physics
Acceso en línea:	Acceder al recurso
Etiquetas:	Agregar Etiqueta Sin Etiquetas, Sea el primero en etiquetar este registro!

Ejemplares similares

Unveiling the Role of Lewis Base Strength in Small-Molecule Passivation of Defect Perovskites
por: Wu, Yi-Chen, et al.
Publicado: (2024)

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

The Quantum Ensemble Variational Optimization Algorithm: Applications to Molecular Inverse Design
por: Calcagno, Francesco, et al.
Publicado: (2025)

Machine Learning Framework for Modeling Exciton-Polaritons in Molecular Materials
por: Li, Xinyang, et al.
Publicado: (2023)

A Comprehensive Computational Framework for Materials Design, Ab Initio Modeling, and Molecular Docking
por: Akanda, Md Rakibul Karim, et al.
Publicado: (2026)

Sensitivity of Photovoltaic Cells Efficiency to Initial Conditions in Various Aggregation Designs
por: Navadel, Baharak Mohamad Jafari, et al.
Publicado: (2024)

Correlation-Converged Virtual Orbitals for Accurate and Efficient Quantum Molecular Simulations
por: Wang, Qian, et al.
Publicado: (2026)

dZiner: Rational Inverse Design of Materials with AI Agents
por: Ansari, Mehrad, et al.
Publicado: (2024)

Interaction-Region Decoupling through Structured Absorbing Potentials: A Framework for Scalable Time-Dependent Quantum Dynamics Calculations
por: Fang, Yuegu, et al.
Publicado: (2025)

Singlet Fission Photovoltaics: Progress and Promising Pathways
por: Baldacchino, Alexander J., et al.
Publicado: (2022)

Benchmarking Hartree-Fock and DFT for Molecular Hyperpolarizability: Implications for Evolutionary Design
por: Mashak, Dominic, et al.
Publicado: (2025)

Quantum Chemistry Driven Molecular Inverse Design with Data-free Reinforcement Learning
por: Calcagno, Francesco, et al.
Publicado: (2025)

Chemical Space of Molecular Nanomotors: Optimizing Photochemical Properties for One- and Two-photon Applications
por: Mielke, Alexander, et al.
Publicado: (2025)

Application of Quantum Annealing to Computation of Molecular Properties
por: Sahoo, Pradyot Pritam, et al.
Publicado: (2025)

Unsymmetrical synthesis of benzimidazole-fused naphthalene imides with panchromatic absorption and redox activity
por: Lin, Guan-Ru, et al.
Publicado: (2025)

Attention-Based Functional-Group Coarse-Graining: A Deep Learning Framework for Molecular Prediction and Design
por: Han, Ming, et al.
Publicado: (2025)

Molecular Machine Learning in Chemical Process Design
por: Rittig, Jan G., et al.
Publicado: (2025)

Enhanced Deep Potential Model for Fast and Accurate Molecular Dynamics; Application to the Hydrated Electron
por: Gao, Ruiqi, et al.
Publicado: (2024)

Semiclassical Nonadiabatic Molecular Dynamics for Molecular Exciton-Polaritons
por: Li, Xinyang, et al.
Publicado: (2024)

Transfer Learning Meets Embedded Correlated Wavefunction Theory for Chemically Accurate Molecular Simulations: Application to Calcium Carbonate Ion-Pairing
por: Bian, Xuezhi, et al.
Publicado: (2026)

Molecular Quantum Control Algorithm Design by Reinforcement Learning
por: Pipi, Anastasia, et al.
Publicado: (2024)

Shift Current Anomalous Photovoltaics in a Double Perovskite Ferroelectric
por: Wei, Linjie, et al.
Publicado: (2025)

GLaD: Synergizing Molecular Graphs and Language Descriptors for Enhanced Power Conversion Efficiency Prediction in Organic Photovoltaic Devices
por: Nguyen, Thao, et al.
Publicado: (2024)

Vibrational Spectra of Materials and Molecules from Partially-Adiabatic Elevated-Temperature Centroid Molecular Dynamics
por: Castro, Jorge, et al.
Publicado: (2025)

Molecular Properties in Quantum-Classical Auxiliary-Field Quantum Monte Carlo: Correlated Sampling with Application to Accurate Nuclear Forces
por: Goings, Joshua J., et al.
Publicado: (2025)

Accurate QM/MM Molecular Dynamics for Periodic Systems in \textsc{GPU4PySCF} with Applications to Enzyme Catalysis
por: Li, Chenghan, et al.
Publicado: (2024)

Intrinsic Dimensionality of Molecular Properties
por: Banjafar, Ali, et al.
Publicado: (2025)

Topological Quantum Molecular Dynamics
por: Xie, Yujuan, et al.
Publicado: (2025)

Design, Assessment, and Application of Machine Learning Potential Energy Surfaces
por: Andreichev, Valerii, et al.
Publicado: (2025)

Review of the Electrochemical Double Layer Theory and Its Applications in Battery Electrode Materials
por: He, Yitao
Publicado: (2025)

Complex Absorbing Potential Green's Function Methods for Resonances
por: Burth, Loris, et al.
Publicado: (2025)

Revisiting Sampling Strategies for Molecular Generation
por: Ni, Yuyan, et al.
Publicado: (2025)

Impact of Cavity on Molecular Ionization Spectra
por: Fábri, Csaba, et al.
Publicado: (2023)

Relativistic Core-Valence-Separated Molecular Mean-Field Exact-Two-Component Equation-of-Motion Coupled Cluster Theory: Applications to L-edge X-ray Absorption Spectroscopy
por: Banerjee, Samragni, et al.
Publicado: (2025)

An Automated Framework for Analyzing Structural Evolution in On-the-fly Non-adiabatic Molecular Dynamics Using Autoencoder and Multiple Molecular Descriptors
por: Liu, Hangxu, et al.
Publicado: (2025)

Knowledge-Reuse Transfer Learning Methods in Molecular and Material Science
por: Chen, An, et al.
Publicado: (2024)

The MolecularWeb Universe: Web-Based, Immersive, Multiuser Molecular Graphics And Modeling, for Education and Work in Chemistry, Structural Biology, and Materials Sciences
por: Abriata, Luciano A.
Publicado: (2025)

Molecular Polarizability under Vibrational Strong Coupling
por: Schnappinger, Thomas, et al.
Publicado: (2025)

Femtosecond Nonadiabatic Confinement of Molecular Dication Yield
por: Marante, Carlos, et al.
Publicado: (2026)

The Ridge Integration Method and its Application to Molecular Sieving, Demonstrated for Gas Purification via Graphdiyne Membranes
por: Binder, Christian W., et al.
Publicado: (2025)