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View article: CSD 1979765: Experimental Crystal Structure Determination
CSD 1979765: Experimental Crystal Structure Determination Open
An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely availabl…
View article: CSD 1979766: Experimental Crystal Structure Determination
CSD 1979766: Experimental Crystal Structure Determination Open
An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely availabl…
View article: CSD 1979764: Experimental Crystal Structure Determination
CSD 1979764: Experimental Crystal Structure Determination Open
An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely availabl…
View article: Polymorphism in toxic medications: exploring the crystal chemistry of lead and cadmium naproxen
Polymorphism in toxic medications: exploring the crystal chemistry of lead and cadmium naproxen Open
Sodium naproxen is widely used as a non-steroidal anti-inflammatory active pharmaceutical ingredient (API).The crystal structure of this API has been reported back in 1990 [1].Despite 3 decades of research on this API, only one single poly…
View article: CSD 2277554: Experimental Crystal Structure Determination
CSD 2277554: Experimental Crystal Structure Determination Open
An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely availabl…
View article: Phase stability and polymorphism of a new naproxen salt
Phase stability and polymorphism of a new naproxen salt Open
We report on thesynthesis and structural characterization of a new naproxen salt. In-situheating X-ray diffraction experiment allows us to determine the phase stabilityof the various polymorphic phases. Slow heating rate and repetitive sca…
View article: Confined Water Cluster Formation in Water Harvesting by Metal–Organic Frameworks: CAU‐10‐H versus CAU‐10‐CH<sub>3</sub>
Confined Water Cluster Formation in Water Harvesting by Metal–Organic Frameworks: CAU‐10‐H versus CAU‐10‐CH<sub>3</sub> Open
Several metal–organic frameworks (MOFs) excel in harvesting water from the air or as heat pumps as they show a steep increase in water uptake at 10–30 % relative humidity (RH%). A precise understanding of which structural characteristics g…
View article: High-Pressure Raman Study of Fe(IO<sub>3</sub>)<sub>3</sub>: Soft-Mode Behavior Driven by Coordination Changes of Iodine Atoms
High-Pressure Raman Study of Fe(IO<sub>3</sub>)<sub>3</sub>: Soft-Mode Behavior Driven by Coordination Changes of Iodine Atoms Open
This document is the Accepted Manuscript version of a Published Work that appeared in final form in The Journal of Physical Chemistry C, copyright © American Chemical Society after peer review and technical editing by the publisher. To acc…
View article: A High-Pressure Investigation of the Synthetic Analogue of Chalcomenite, CuSeO3∙2H2O
A High-Pressure Investigation of the Synthetic Analogue of Chalcomenite, CuSeO3∙2H2O Open
Synthetic chalcomenite-type cupric selenite CuSeO3∙2H2O has been studied at room temperature under compression up to pressures of 8 GPa by means of single-crystal X-ray diffraction, Raman spectroscopy, and density-functional theory. Accord…
View article: A High-pressure Investigation of the Synthetic Analogue of Chalcomenite, CuSeO<sub>3</sub>∙2H<sub>2</sub>O
A High-pressure Investigation of the Synthetic Analogue of Chalcomenite, CuSeO<sub>3</sub>∙2H<sub>2</sub>O Open
Synthetic chalcomenite-type cupric selenite CuSeO3∙2H2O has been studied at room temperature under compression up to pressures of 8 GPa by means of single-crystal X-ray diffraction, Raman spectroscopy, and density-functional theory. Accord…
View article: Pure gyrotropic ferroelastic phase transitions in the materials Pb<i>MX</i>O<sub>4</sub> (<i>M</i> = Ba, Sr; <i>X</i> = Si, Ge): a new piezoelectric family
Pure gyrotropic ferroelastic phase transitions in the materials Pb<i>MX</i>O<sub>4</sub> (<i>M</i> = Ba, Sr; <i>X</i> = Si, Ge): a new piezoelectric family Open
Gyrotropic phase transitions are characterized by the appearance of a spontaneous optical activity [1].The appearance of such activity is very common in ferroelectric materials.In such materials, the optical activity is a secondary order p…
View article: Crystal structure and thermodynamic behaviour of Bi<sub>6</sub>Te<sub>2</sub>O<sub>15</sub>: the likely structure of the rare mineral pingguite
Crystal structure and thermodynamic behaviour of Bi<sub>6</sub>Te<sub>2</sub>O<sub>15</sub>: the likely structure of the rare mineral pingguite Open
Pingguite is a rare mineral reported for the first time in 1994 [1].However, its crystal structure was not reported, only cell parameters and the existence of a phase transition around 800°C [1,2].With this contribution, we aim to shade so…
View article: Pure gyrotropic phase transitions in the arcanite-related materials Pb<i>M</i>GeO<sub>4</sub> (<i>M</i> = Ba, Sr)
Pure gyrotropic phase transitions in the arcanite-related materials Pb<i>M</i>GeO<sub>4</sub> (<i>M</i> = Ba, Sr) Open
Pure gyrotropic phase transitions in the arcanite related materials PbMGeO 4 (M = Ba, Sr) 1 Europe
View article: Kalistrontite, its occurrence, structure, genesis, and significance for the evolution of potash deposits in North Yorkshire, U.K.
Kalistrontite, its occurrence, structure, genesis, and significance for the evolution of potash deposits in North Yorkshire, U.K. Open
The rare mineral kalistrontite, K
\n2
\nSr(SO
\n4
\n)
\n2
\n, has been discovered in exceptional quantities in exploration boreholes
\ntargeting Permian polyhalite [K
\n2
\nCa
\n2
\nMg(SO
\n4
\n)
\n4
\n·2(H
\n2
\nO)]-bearing evaporite dep…
View article: Characterizing proteins using SAXS on a multi-purpose laboratory X-ray diffractometer
Characterizing proteins using SAXS on a multi-purpose laboratory X-ray diffractometer Open
Small-angle X-ray scattering (SAXS) applied to protein solutions has become an accepted and rapidly growing structural biology technique [1].Measurements can be done under native conditions, while varying concentration, pH, ionic strength …
View article: Crystal structure and polymorphism of a new larnite vanadate: NaSrVO<sub>4</sub>
Crystal structure and polymorphism of a new larnite vanadate: NaSrVO<sub>4</sub> Open
The crystal chemistry of AIBIIXO4 (AI = alkali ion, BII = alkali-earth ion, X = P, V, As) is very rich and leads to numerous polymorphic phases which belong to numerous structures types, such as olivine, arcanite, glaserite, tridymite, α-K…
View article: Humidity-induced phase transitions of HEW lysozyme investigated by powder diffraction
Humidity-induced phase transitions of HEW lysozyme investigated by powder diffraction Open
The simplicity of XRPD data collection and the uniqueness of the diffraction pattern that each polymorph shows, marks powder diffraction as the most suitable technique for quick and accurate characterization of microcrystalline suspensions…
View article: Crystal structure and polymorphism of NaSrVO<sub>4</sub>: the first <i>A</i> <sup>I</sup> <i>B</i> <sup>II</sup> <i>X</i> <sup>V</sup>O<sub>4</sub> larnite-related structure from X-ray powder diffraction data
Crystal structure and polymorphism of NaSrVO<sub>4</sub>: the first <i>A</i> <sup>I</sup> <i>B</i> <sup>II</sup> <i>X</i> <sup>V</sup>O<sub>4</sub> larnite-related structure from X-ray powder diffraction data Open
The crystal chemistry of A I B II XO 4 (A I = alkali ion, B II = alkali-earth ion, X = P, V, As) is very rich and leads to numerous polymorphic phases which belong to several structures types: olivine, arcanite, glaserite, tridymite, α-K 2…
View article: Coxsackievirus B3 protease 3C: expression, purification, crystallization and preliminary structural insights
Coxsackievirus B3 protease 3C: expression, purification, crystallization and preliminary structural insights Open
Viral proteases are proteolytic enzymes that orchestrate the assembly of viral components during the viral life cycle and proliferation. Here, the expression, purification, crystallization and preliminary X-ray diffraction analysis are pre…
View article: Structural and magnetic properties of the low dimensional fluoride β-FeF<sub>3</sub>.3H<sub>2</sub>O
Structural and magnetic properties of the low dimensional fluoride β-FeF<sub>3</sub>.3H<sub>2</sub>O Open
The structures of new compound [CuX(pyz) 2 ](BF 4 ) with X = Cl -and Br -and pyz = pyrazine were determined by single crystal X-ray diffraction.These tetragonal compounds crystallize in space group P4/nbm.They are built from [Cu(pyz) 2 ] 2…
View article: Humidity induced phase transitions of HEW lysozyme investigated by microcrystalline powder diffraction
Humidity induced phase transitions of HEW lysozyme investigated by microcrystalline powder diffraction Open
Co-crystallisation is a common method for producing protein-ligand complex structures.It is especially useful when drug-like compounds trigger conformational changes in proteins.This can result in variations in the growing conditions or cr…