Results 221 to 230 of about 311,819 (318)

Ontology‐Aligned Structuring and Reuse of Multimodal Materials Data and Workflows Toward Automatic Reproduction

Advanced Engineering Materials, EarlyView.
Reproduction of stacking fault energy calculations from literature with a semi‐automated large language model‐assisted extraction procedure: extraction of simulation protocol, atomistic structures, computational parameters, and reported results, ontology alignment, knowledge graph construction and, finally, recomputation forvalidation.
Sepideh Baghaee Ravari, Abril Azocar Guzman, Sarath Menon, Stefan Sandfeld, Tilmann Hickel, Markus Stricker   +5 more
wiley   +1 more source

Chiral 3D Perovskite Single Crystals Realized by Lattice Expansion. [PDF]

Adv Sci (Weinh)
Wang L, Hao W, Chen S, Ren J, Li H.
europepmc   +1 more source

Enhanced Strength and Corrosion Resistance of Ti‐13Nb‐12Ta‐10Zr‐4Sn Alloy by Aging Treatment

Advanced Engineering Materials, EarlyView.
This work systematically investigates the effect of aging treatment on mechanical properties and corrosion behavior of vacuum arc‐melted Ti‐13Nb‐12Ta‐10Zr‐4Sn alloy. Owing to the increased α″ martensite, strength and corrosion resistance were significantly enhanced by aging treatment.
Yuhua Li, Rong Zhao, Qian Zhang, Haojie Wang, Yujing Liu, Lai‐Chang Zhang   +5 more
wiley   +1 more source

Epitaxial growth of wafer-scale 2D superconductor single crystals by metal-organic chemical vapor deposition. [PDF]

Nat Commun
Wang Z, Luo T, Shi L, Chen X, Zhang J, Yao Z, Lu J, Huang Y, Zhu Z, Zheng L, Li M, Kis A, Zhang L, Zhang J.   +13 more
europepmc   +1 more source

Direct Metal Deposition of Graphene–Ti28Nb35.4Zr Matrix Composites With Enhanced Mechanical, Corrosion, and Biocompatibility Properties for Bone Implants

Advanced Engineering Materials, EarlyView.
Graphene nanoplatelet (0.1 wt.%) reinforcement significantly enhances the performance of β Ti‐28Nb‐35.4Zr alloy. Grain refinement, reduced water contact angle, and improved surface characteristics promote osteoblast adhesion and complete surface coverage after 7 days.
Khurram Munir, Jixing Lin, Yuncang Li, Li Zhu, Paul F. A. Wright, Cuie Wen   +5 more
wiley   +1 more source

Sterically Controlled Template-Assisted Macrocyclization of Hemisquaraine Rotaxanes: Synthesis, Characterization, and DFT Calculations

SynOpen
Petro M. Radionov, Alexander V. Kyrychenko, Rostyslav P. Svoiakov, Olga S. Kolosova, Hanna S. Vlasenko, Anatoliy L. Tatarets, Olesia G. Kulyk   +6 more
doaj   +1 more source

Realizing 303 ps Ultrafast Scintillation Time in 2-Inch CsPbCl₃ Single Crystals Grown Under Br₂ Overpressure. [PDF]

Materials (Basel)
Yang J, Wang F, Chen L, Bo T, Chai Z, Lin W.   +5 more
europepmc   +1 more source

Toward Knowledge‐Based Workflows: A Semantic Approach to Atomistic Simulations for Mechanical and Thermodynamic Properties

Advanced Engineering Materials, EarlyView.
Knowledge‐based atomistic workflows are presented for mechanical and thermodynamic properties. By coupling modular simulations with ontology‐aligned metadata and provenance, Fe case studies on elastic behavior, defects, thermal properties, and Hall–Petch strengthening reveal how FAIR, queryable, and reusable simulation data can be generated. Mechanical
Abril Azócar Guzmán, Hoang‐Thien Luu, Sarath Menon, Tilmann Hickel, Nina Merkert, Stefan Sandfeld   +5 more
wiley   +1 more source

Chemical and hydrostatic pressure induced metallization in [Formula: see text] [Formula: see text] single crystals. [PDF]

Sci Rep
Hussain T, Choi J, Omran M, Han G, Kim C, Kang W, Nauman M, Jo Y.   +7 more
europepmc   +1 more source

Cathodic Cage Plasma Deposition of Nanostructured Cu–Fe–Se Coatings on Poly(methyl Methacrylate)

Advanced Engineering Materials, EarlyView.
Nanostructured Cu–Fe–Se coatings are deposited on PMMA by a modified cathodic cage plasma process, enabling low‐temperature deposition on polymer substrates. A transition from discontinuous to compact morphology is observed with temperature, with optimal properties at 200°C, where improved CuFeSe2‐type bonding, lowest sheet resistance, and favorable ...
V. S. S. Sobrinho, M. Naeem, T. H. C. Costa, M. S. Libório, J. C. A. Queiroz, C. B. B. Luna, R. R. M. Sousa, P. S. Vieira, E. M. Araújo   +8 more
wiley   +1 more source