Results 61 to 70 of about 742 (250)

Grain Refinement During Severe Plastic Deformation and Similitude of Subgrain Formation: A Molecular Dynamics Study

Advanced Engineering Materials, EarlyView.
Molecular dynamics is used to investigate structure refinement during severe plastic deformation. The results show similitude with experimental data. Molecular dynamics simulations of severe plastic deformation of monocrystalline and polycrystalline samples by multiaxial compression of aluminum are carried out.
Roberto B. Figueiredo
wiley   +1 more source

On extremal numbers of the triangle plus the four-cycle

Forum of Mathematics, Sigma
For a family $\mathcal {F}$ of graphs, let ${\mathrm {ex}}(n,\mathcal {F})$ denote the maximum number of edges in an n-vertex graph which contains none of the members of $\mathcal {F}$ as a subgraph.
Jie Ma, Tianchi Yang
doaj   +1 more source

New AI‐Assisted Approach for Expanding the Solution Space: Application to Lattice Structure Design

Advanced Engineering Materials, EarlyView.
This work introduces an innovative framework for designing structured materials by ex panding the design space through reparameterization of qualitative variables into continuous structural descriptors. Combined with machine‐learning‐based prediction and multi‐objective optimization, the approach enables the discovery of novel lattice architectures ...
G. H. Gahimbare, Y. Beideler, D. Chune, R. De Guio, T. Roland, H. Chibane   +5 more
wiley   +1 more source

Bio‐Inspired Synthesis of Macroporous Single Crystal Particles as Scattering Agents

Advanced Functional Materials, EarlyView.
A general strategy is presented that delivers unique, single‐crystal microparticles that combine submicron macroporosity and uniform particle shapes. A bioinspired approach is used to occlude three distinct types of additives – polystyrene microspheres, polymer vesicles and amino acids – within calcite single crystals, and subsequent thermal annealing ...
Stephanie E. Foster, Gianni Jacucci, Ouassef Nahi, Thomas Kress, Zabeada Aslam, Stuart Micklethwaite, Alexander N. Kulak, Rik Drummond‐Brydson, Melinda J. Duer, Yi‐Yeoun Kim, Silvia Vignolini, Fiona C. Meldrum   +11 more
wiley   +1 more source

Weighted Asymmetry Index: A New Graph-Theoretic Measure for Network Analysis and Optimization

Mathematics
Graph theory is a crucial branch of mathematics in fields like network analysis, molecular chemistry, and computer science, where it models complex relationships and structures.
Ali N. A. Koam, Muhammad Faisal Nadeem, Ali Ahmad, Hassan A. Eshaq   +3 more
doaj   +1 more source

Extreme coefficients of Jones polynomials and graph theory [PDF]

Journal of Knot Theory and Its Ramifications, 2004
We find families of prime diagrams of knots with arbitrary extreme coefficients in their Jones polynomials. Some graph theory is presents in connection with this problem, generalizing ideas by Yongju Bae and Morton [4] and giving a positive answer to a question in their paper.
openaire   +2 more sources

Artificial Intelligence‐Assisted Workflow for Transmission Electron Microscopy: From Data Analysis Automation to Materials Knowledge Unveiling

Advanced Materials, EarlyView.
AI‐Assisted Workflow for (Scanning) Transmission Electron Microscopy: From Data Analysis Automation to Materials Knowledge Unveiling. Abstract (Scanning) transmission electron microscopy ((S)TEM) has significantly advanced materials science but faces challenges in correlating precise atomic structure information with the functional properties of ...
Marc Botifoll, Ivan Pinto‐Huguet, Enzo Rotunno, Thomas Galvani, Catalina Coll, Payam Habibzadeh Kavkani, Maria Chiara Spadaro, Yann‐Michel Niquet, Martin Børstad Eriksen, Sara Martí‐Sánchez, Georgios Katsaros, Giordano Scappucci, Peter Krogstrup, Giovanni Isella, Andreu Cabot, Gonzalo Merino, Pablo Ordejón, Stephan Roche, Vincenzo Grillo, Jordi Arbiol   +19 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

Advanced 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

Extremal unicyclic and bicyclic graphs with respect to the -index

AKCE International Journal of Graphs and Combinatorics, 2017
In the study of structure-dependency of the total -electron energy in 1972, it was shown that this energy depends on the degree based sum and , where is the degree of a vertex of under consideration molecular graph .
Shehnaz Akhter, Muhammad Imran, Mohammad Reza Farahani   +2 more
doaj   +1 more source

Forcing subarrangements in complete arrangements of pseudocircles

Journal of Computational Geometry, 2015
In arrangements of pseudocircles (i.e., Jordan curves) the weight of a vertex (i.e., an intersection point) is the number of pseudocircles that contain the vertex in its interior.
Ronald Ortner
doaj   +1 more source