Development of a Finite Element Model for the HAZ Temperature Field in Longitudinal Welding of Pipeline Steel by Zhixing Wang, Chengjia Shang, Xuelin Wang

“…Its development involved the innovative integration of microstructural crystallography information with a multi-scale calibration and validation methodology. …”
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Structural Analysis of Inhibitor Binding to Enterovirus-D68 3C Protease by Vincent N. Azzolino, Ala M. Shaqra, Akbar Ali, Nese Kurt Yilmaz, Celia A. Schiffer

“…Here, we characterize a series of 3C inhibitors against EV68-3C protease through enzyme inhibition, protein crystallography, and structural analysis. We have determined and analyzed three high-resolution inhibitor-bound crystal structures of EV68-3C protease, which revealed possible sites of resistance mutations, a key structural water molecule conserved during ligand binding, and the conformational flexibility of the catalytic histidine H40. …”
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Comparative study of crystallization kinetics and phase segregation of triple cation and methylammonium lead iodide perovskites on moisture probing using synchrotron X-ray based ra... by Miller Shatsala, Stellah Wanyonyi, Celline Awino, Maxwell Mageto, Hussein Golicha

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Crystallographic defects induced F-Center and optical enhancements in CeO2-TiO2 nanocomposites by Samor Boonphan, Suriyong Prachakiew, Chaiyuth Nontakoat, Yanee Keereeta, Chatdanai Boonruang, Arrak Klinbumrung

“…This study reports the synthesis and characterization of CeO2-TiO2 nanocomposites, focusing on the crystallography and defects in enhancing optical properties. …”
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Hard X-ray single-shot spectrometer of PAL-XFEL by Sangsoo Kim, Jae Hyuk Lee, Daewoong Nam, Gisu Park, Myong-jin Kim, Intae Eom, Inhyuk Nam, Chi Hyun Shim, Jangwoo Kim

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Incommensurately modulated structure of Zn4Si2O7(OH)2·H2O at high pressure by Roman Gajda, Wojciech Sławiński, Tomasz Poręba, Jan Parafiniuk, Mohamed Mezouar, Przemysław Dera, Krzysztof Woźniak

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Synthesis and crystal structures of 4,4′-methylenebis(2,6-diethylaniline) and 4,4′-methylenebis(3-chloro-2,6-diethylaniline) by Daniil E. Smirnov, Oleg S. Morozov, Ekaterina S. Afanasyeva, Viktor V. Avdeev

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Phase Transition and Controlled Zirconia Implant Patterning Using Laser-Induced Shockwaves by Inomjon Majidov, Yaran Allamyradov, Salizhan Kylychbekov, Zikrulloh Khuzhakulov, Ali Oguz Er

“…SEM, AFM, and XRD analyses were used to characterize the surface morphology and crystallography. Protein adsorption studies compared two patterned samples with different surface coverage—the first sample had a patterned area of 0.212 cm² (27%), while the second sample had a patterned area of 0.283 cm² (36%)—to a control sample. …”
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Synthesis, crystal structure and Hirshfeld surface analysis of 5,5-diphenyl-2-[2-(propan-2-ylidene)hydrazin-1-yl]-4,5-dihydro-1H-imidazol-4-one N,N-dimethylformamide hemisolvate by Abderrazzak El Moutaouakil Ala Allah, Benson M. Kariuki, Walid Guerrab, Abdulsalam Alsubari, Musa A. Said, Joel T. Mague, Youssef Ramli

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Crystal structure and elastic properties of parabreyite: a new high-pressure ring silicate in the CaSiO₃ system by B. Chrappan Soldavini, M. Merlini, M. Gemmi, P. Parlanti, P. Fumagalli, S. Milani, B. Joseph, G. Bais, M. Polentarutti, A. Kurnosov, S. Poli

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Toward a storage ring coherent light source based on an angular dispersion-induced microbunching scheme by Changliang Li, Bocheng Jiang, Chao Feng, Qiang Gu, Zhenghe Bai, Weishi Wan, Qinglei Zhang, Kun Wang

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Crystal structure of catena-poly[bis(N,O-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]] by Valerii Y. Sirenko, Mircea-Odin Apostu, Irina A. Golenya, Dina D. Naumova, Sofiia V. Partsevska

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Benchmarking protein language models for protein crystallization by Raghvendra Mall, Rahul Kaushik, Zachary A. Martinez, Matt W. Thomson, Filippo Castiglione

“…Abstract The problem of protein structure determination is usually solved by X-ray crystallography. Several in silico deep learning methods have been developed to overcome the high attrition rate, cost of experiments and extensive trial-and-error settings, for predicting the crystallization propensities of proteins based on their sequences. …”
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Crystal structures of (±)-(1SR,5SR,6SR,7SR,10SR,11SR,13RS,14SR,15SR,16RS)-13-acetoxy-16-benzyloxy-15-hydroxy-7-methoxymethoxy-3-oxo-11,15,18,18-tetramethyl-2,4-dioxatetracyclo[12.3... by Takeshi Oishi, Keisuke Fukaya, Takaaki Sato, Noritaka Chida

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Observation of Body‐Centered‐Cubic Cu Nanocluster with Partial Cu(0) Character by Pu Gao, Jing Du, Weijie Hong, Mingzai Wu, Yan Feng, Yanjun Ding, Manzhou Zhu

“…Herein, a Cu(0)‐containing Cu NC is first reported to contain a metallic framework of 23 Cu atoms with a body‐centered‐cubic Cu@Cu8 core, stabilized by 6 triphenylphosphine (TPP) and 18 4‐methylbenzenethiolate ligands, as determined by single‐crystal X‐ray crystallography. The observed structure stands in stark contrast to the FCC and other structures reported for Cu NCs. …”
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Crystal structure and Hirshfeld surface analysis of supramolecular aggregate of 2,2,6,6-tetramethylpiperidin-1-ium bromide with 1,2,3,4-tetrafluoro-5,6-diiodobenzene by Atash V. Gurbanov, Tuncer Hökelek, Gunay Z. Mammadova, Khudayar I. Hasanov, Tahir A. Javadzade, Alebel N. Belay

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Marine carbon burial enhanced by microbial carbonate formation at hydrocarbon seeps by Daniel Smrzka, Yiting Tseng, Jennifer Zwicker, Andrea Schröder-Ritzrau, Norbert Frank, Anne-Désirée Schmitt, Thomas Pape, Daniel Birgel, Jörn Peckmann, Saulwood Lin, Gerhard Bohrmann

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The use of ethanol as contrast enhancer in synchrotron X-ray phase-contrast imaging leads to heterogeneous myocardial tissue shrinkage: a case report by Gabriel Bernardino, Àngels Calvet-Mirabent, Hector Dejea, Eduard Guasch, Anne Bonnin, Patricia Garcia-Canadilla

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Lagorio’s Wall in the Crimea: pages of scientific activity of the geologist Oleksandr Lagorio by Dmytro Mikhalenok

“…In the latter, a wide profiled scientific school of the scientist was formed, including synthetic geology (experimental mineralogy and petrography)—the most well-known representative of which was the Polish scientist Józef Morozewicz, crystallography (Georg Wulff), and applied and theoretical geology (Dmitro M. …”
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Substituted 4-Acyl-5-methyl-2-phenyl-pyrazol-3-one-phenylhydrazones with Antioxidant Properties: X-Ray Crystal and Spectroscopic Studies by Omoruyi G. Idemudia, Anthony I. Okoh, Alexander P. Sadimenko, Eric C. Hosten, Omobola O. Okoh

“…The keto imine tautomers of 4-ethyl-5-methyl-2-phenyl-pyrazol-3-one-phenylhydrazone (Empp-Ph) and 4-propyl-5-methyl-2-phenyl-pyrazol-3-one-phenylhydrazone (Prmpp-Ph) according to single X-ray crystallography data which precipitated in good yield are reported. …”
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