Results 51 to 60 of about 6,496,921 (270)

Accurate crystal structure of ice VI from X-ray diffraction with Hirshfeld atom refinement

IUCrJ, 2022
Water is an essential chemical compound for living organisms, and twenty of its different crystal solid forms (ices) are known. Still, there are many fundamental problems with these structures such as establishing the correct positions and thermal ...
Michal L. Chodkiewicz, Roman Gajda, Barbara Lavina, Sergey Tkachev, Vitali B. Prakapenka, Przemyslaw Dera, Krzysztof Wozniak   +6 more
doaj   +1 more source

Revisiting Stability Criteria in Ball‐Milled High‐Entropy Alloys: Do Hume–Rothery and Thermodynamic Rules Equally Apply?

Advanced Engineering Materials, Volume 27, Issue 6, March 2025.
The stability criteria affecting the formation of high‐entropy alloys, particularly focusing in supersaturated solid solutions produced by mechanical alloying, are analyzed. Criteria based on Hume–Rothery rules are distinguished from those derived from thermodynamic relations. The formers are generally applicable to mechanically alloyed samples.
Javier S. Blázquez, Alejandro F. Manchón‐Gordón, Antonio Vidal‐Crespo, Rafael Caballero‐Flores, Jhon J. Ipus, Clara F. Conde   +5 more
wiley   +1 more source

Redetermination of the crystal structure of NbF4

Acta Crystallographica Section E: Crystallographic Communications, 2016
Single crystals of NbF4, niobium(IV) tetrafluoride, were synthesized by disproportionation of Nb2F5 at 1273 K in a sealed niobium tube, extracted and studied by single-crystal X-ray diffraction.
Jascha Bandemehr, Matthias Conrad, Florian Kraus   +2 more
doaj   +1 more source

Nonlinear optical behaviour of bis (cytosinium) tartarate monohydrate single crystal

Chemical Physics Impact, 2022
A nonlinear optical single crystal of bis (cytosinium) tartarate monohydrate (BCTM) was grown by slow evaporation method at room temperature. Single crystal X-ray diffraction study revealed their cell parameters and corresponding space group.
P. Jaikumar, T. Balakrishnan, C. Indumathi, T.C. Sabari Girisun, K. Ramamurthi   +4 more
doaj   +1 more source

A Workflow to Accelerate Microstructure‐Sensitive Fatigue Life Predictions

Advanced Engineering Materials, EarlyView.
This study introduces a workflow to accelerate predictions of microstructure‐sensitive fatigue life. Results from frameworks with varying levels of simplification are benchmarked against published reference results. The analysis reveals a trade‐off between accuracy and model complexity, offering researchers a practical guide for selecting the optimal ...
Luca Loiodice, Krzysztof S. Stopka, Michael D. Sangid   +2 more
wiley   +1 more source

Microstructural Evolution and Vacancy Defect Formation in Mn–Mo–Ni RPV Steel Under Low Cycle Fatigue: Insights From EBSD and PALS

Advanced Engineering Materials, EarlyView.
Low‐cycle fatigue damage in Mn–Mo–Ni reactor pressure vessel steel is examined using a combined electron backscatter diffraction and positron annihilation lifetime spectroscopy approach. The study correlates texture evolution, dislocation substructure development, and vacancy‐type defect formation across uniform, necked, and fracture regions, providing
Apu Sarkar, Dhanadeep Dutta, G. Bharat Reddy   +2 more
wiley   +1 more source

Automated Orientation and Diffraction Intensity (AODI) Mapping on a Curved Surface

Crystals
A method for automated orientation and diffraction intensity (AODI) mapping on a curved surface has been established at the Shanghai Synchrotron Radiation Facility (SSRF).
Cheng Pan, Zhijun Wang, Xingyu Gao
doaj   +1 more source

Thermodynamic Pathways of Nonequilibrium Solidification in Wire‐Arc Additive Manufacturing Fe‐Based Multicomponent Alloy Structures

Advanced Engineering Materials, EarlyView.
Geometry‐driven thermal behavior in wire‐arc additive manufacturing (WAAM) influences microstructural evolution during nonequilibrium solidification of a chemically complex Fe–Cr–Nb–W–Mo–C nanocomposite system. By comparing different deposits configurations, distinct entropy–cooling rate correlations, segregation, and carbide evolution are revealed ...
Blanca Palacios, Anthony Gonzalez, Aleksander Aleman, Tyler Dolmetsch, Tanaji Paul, Arvind Agarwal   +5 more
wiley   +1 more source

A robotic goniometer exchanger for high-throughput single-crystal X-ray diffraction at SPring-8

Journal of Synchrotron Radiation
Rapid and reliable sample handling is essential for high-throughput single-crystal diffraction at modern synchrotron facilities. At the high-energy single-crystal X-ray diffraction beamline BL02B1 of SPring-8, a compact six-axis robotic arm was ...
Yuiga Nakamura, Sumit Ranjan Maity, Toshiyuki Sasaki, Kouhei Ichiyanagi   +3 more
doaj   +1 more source

Ca2CuO2Cl2, a redetermination from single-crystal X-ray diffraction data

IUCrData, 2018
The crystal structure of Ca2CuO2Cl2, dicalcium oxidocuprate(II) dichloride, was redetermined on the basis of single-crystal X-ray diffraction data using a laboratory Mo anode. Previous structure determinations based on single-crystal X-ray data [Grande &
Benoît Baptiste, Masaki Azuma, Runze Yu, Paola Giura, Matteo d'Astuto   +4 more
doaj   +1 more source