Results 81 to 90 of about 1,417 (232)

Solvent‐Free Thermal Defect Engineering in Molecular Frameworks With Volatile Linkers

open access: yesAdvanced Materials, EarlyView.
Thermal removal of neutral volatile linkers enables precise and solvent‐free generation of metal vacancies in MOFs. This strategy affords redox‐stable, coordinatively unsaturated FeII sites with tunable spin, ligand coordination, and catalytic behavior. The approach offers a general route to design defect‐functional materials through local coordination
Sonia Martínez‐Giménez   +9 more
wiley   +1 more source

POM‐Based Water Splitting Catalyst Under Acid Conditions Driven by Its Assembly on Carbon Nanotubes

open access: yesAdvanced Materials, EarlyView.
A newly‐engineered POM‐based electrocatalyst incorporating non‐innocent counter cations exhibits fast kinetics for either the OER or HER under strongly acidic conditions (1 m H2SO4), depending on whether it is assembled on carbon nanotubes (1@CNT) or physically mixed with them (1/CNT). In water‐splitting tests using a two‐electrode setup, these systems
Eugenia P. Quirós‐Díez   +8 more
wiley   +1 more source

On the maximum atom-bond sum-connectivity index of unicyclic graphs with given diameter

open access: yesAIMS Mathematics
<p>Let $ G = (V(G), E(G)) $ be a simple connected graph with vertex set $ V(G) $ and edge set $ E(G) $. The atom-bond sum-connectivity (ABS) index was proposed recently and is defined as $ ABS(G) = \sum_{uv\in E(G)}\sqrt{\frac{d_{G}(u)+d_{G}(v)-2}{d_{G}(u)+d_{G}(v)}} $, where $ d_{G}(u) $ represents the degree of vertex $ u\in V(G) $. A connected
Zhen Wang, Kai Zhou
openaire   +2 more sources

Polyimide‐Linked Hexaazatriphenylene‐Based Porous Organic Polymer with Multiple Redox‐Active Sites as a High‐Capacity Organic Cathode for Lithium‐Ion Batteries

open access: yesAdvanced Materials, EarlyView.
A high‐capacity polyimide‐linked porous organic polymer (HAT‐PTO) incorporating numerous redox‐active centers is synthesized via a hydrothermal reaction, delivering a high theoretical capacity of 484 mAh g−1. In situ hybridization with carboxyl‐functionalized multiwalled carbon nanotubes enhances conductivity and stability, achieving 397 mAh g−1 at C ...
Arindam Mal   +7 more
wiley   +1 more source

Minimum atom-bond sum-connectivity index of trees with a fixed order and/or number of pendent vertices

open access: yesAIMS Mathematics
<abstract><p>Let $ d_u $ be the degree of a vertex $ u $ of a graph $ G $. The atom-bond sum-connectivity (ABS) index of a graph $ G $ is the sum of the numbers $ (1-2(d_v+d_w)^{-1})^{1/2} $ over all edges $ vw $ of $ G $. This paper gives the characterization of the graph possessing the minimum ABS index in the class of all trees of a ...
Tariq A. Alraqad   +5 more
openaire   +3 more sources

A Cu‐Based Near‐IR Active MOF with an Ion‐Pair Guest Exhibiting Versatile and Selective Gas‐Solid Reactivity

open access: yesAdvanced Materials, EarlyView.
The new Cu‐containing MOF (Me2NH2)(CuICl2)@[Cu4(INA)4Cl2O]·1.5dmf (3) contains a cation and an anion as guests and shows UV‐near‐mid‐IR absorption and near‐IR emission. MOF 3 shows gas‐solid reactivity in the presence of NH3 and HCOOH to yield two new 3D MOF.
Rajat Saha   +10 more
wiley   +1 more source

Mechanically Programmable DNA Hydrogel Microparticles for 3D Cellular Systems

open access: yesAdvanced Materials, EarlyView.
DNA hydrogel microparticles are designed to exhibit controllable viscoelasticity and stiffness across three orders of magnitude from 30Pa$30 \,\mathrm{Pa}$ to 6.5kPa$6.5 \,\mathrm{kPa}$. They are uptaken into fibroblast spheroids where they are actively remodeled by cellular forces depending on their mechanical properties.
Tobias Walther   +9 more
wiley   +1 more source

On the spectral radius of atom-bond maximum degree-based sum-connectivity matrix and its applications as molecular descriptors

open access: yesKuwait Journal of Science
matrices have been extensively studied. One of the modified versions of Randić index is the index 𝑅′ (𝐺) = ∑ 𝑣𝑖∼𝑣𝑗 1 / max{𝑑𝑖 , 𝑑𝑗 } , where 𝑑𝑖 and 𝑑𝑗 are the vertex degrees of 𝑣𝑖 and 𝑣𝑗 , respectively.
B.R. Rakshith   +2 more
doaj   +1 more source

Azaporphyrinoid‐Based Photo‐ and Electroactive Architectures for Advanced Functional Materials

open access: yesAdvanced Materials, EarlyView.
A long‐standing collaboration between the Torres and Guldi groups has yielded diverse azaporphyrinoid‐based donor‐acceptor nanohybrids with promising applications in solar energy conversion. This conspectus highlights key molecular platforms and structure‐function relationships that govern light and charge management, supporting the rational design of ...
Jorge Labella   +3 more
wiley   +1 more source

Self‐Assembled Monolayers in p–i–n Perovskite Solar Cells: Molecular Design, Interfacial Engineering, and Machine Learning–Accelerated Material Discovery

open access: yesAdvanced Materials, EarlyView.
This review highlights the role of self‐assembled monolayers (SAMs) in perovskite solar cells, covering molecular engineering, multifunctional interface regulation, machine learning (ML) accelerated discovery, advanced device architectures, and pathways toward scalable fabrication and commercialization for high‐efficiency and stable single‐junction and
Asmat Ullah, Ying Luo, Stefaan De Wolf
wiley   +1 more source

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