| People | Locations | Statistics |
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| Naji, M. |
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| Motta, Antonella |
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| Aletan, Dirar |
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| Mohamed, Tarek |
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| Ertürk, Emre |
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| Taccardi, Nicola |
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| Kononenko, Denys |
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| Petrov, R. H. | Madrid |
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| Alshaaer, Mazen | Brussels |
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| Bih, L. |
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| Casati, R. |
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| Muller, Hermance |
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| Kočí, Jan | Prague |
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| Šuljagić, Marija |
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| Kalteremidou, Kalliopi-Artemi | Brussels |
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| Azam, Siraj |
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| Ospanova, Alyiya |
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| Blanpain, Bart |
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| Ali, M. A. |
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| Popa, V. |
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| Rančić, M. |
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| Ollier, Nadège |
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| Azevedo, Nuno Monteiro |
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| Landes, Michael |
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| Rignanese, Gian-Marco |
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Dubrovinskaia, Natalia
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (26/26 displayed)
- 2023Structure determination of ζ-N2 from single-crystal X-ray diffraction and theoretical suggestion for the formation of amorphous nitrogencitations
- 2022Synthesis of Ultra-Incompressible Carbon Nitrides Featuring Three-Dimensional Frameworks of CN4 Tetrahedra Recoverable at Ambient Conditions
- 2022Fe0.79Si0.07B0.14 metallic glass gaskets for high-pressure research beyond 1 Mbarcitations
- 2022High-pressure synthesis of seven lanthanum hydrides with a significant variability of hydrogen contentcitations
- 2022Synthesis, crystal structure, and properties of stoichiometric hard tungsten tetraboride, WB4citations
- 2022Domain Auto Finder (DAFi) program: the analysis of single-crystal X-ray diffraction data from polycrystalline samplescitations
- 2022Fe₀.₇₉Si₀.₀₇B₀.₁₄ metallic glass gaskets for high-pressure research beyond 1Mbarcitations
- 2021Nitrosonium nitrate (NO+NO3−) structure solution using in situ single-crystal X-ray diffraction in a diamond anvil cellcitations
- 2021High-Pressure Yttrium Nitride, $Y_{5}N_{14}$, Featuring Three Distinct Types of Nitrogen Dimerscitations
- 2021Nitrosonium nitrate (NO$^+$NO$_3$$^{−}$) structure solution using in situ single-crystal X-ray diffraction in a diamond anvil cellcitations
- 2021High-Pressure Synthesis of Dirac Materials: Layered van der Waals Bonded BeN$_{4}$ Polymorphcitations
- 2021High-Pressure Synthesis of the $β-Zn_{3}N_{2}$ Nitride and the $α-ZnN_{4}$ and $β-ZnN_{4}$ Polynitrogen Compoundscitations
- 2020Novel sulfur hydrides synthesized at extreme conditionscitations
- 2020High-Pressure Polymeric Nitrogen Allotrope with the Black Phosphorus Structurecitations
- 2020Proton mobility in metallic copper hydride from high-pressure nuclear magnetic resonancecitations
- 2019Equations of state of rhodium, iridium and their alloys up to 70 GPacitations
- 2019High-pressure synthesis of ultraincompressible hard rhenium nitride pernitride Re2(N2)(N)2 stable at ambient conditionscitations
- 2018Disorder–order transitions in the perovskite metal–organic frameworks [(CH₃)₂NH₂][M(HCOO)₃] at high pressurecitations
- 2018Disorder–order transitions in the perovskite metal–organic frameworks $[(CH_{3})_{2}NH_{2} ][M(HCOO)_{3}]$ at high pressurecitations
- 2017Effect of composition on compressibility of skiagite-Fe-majorite garnetcitations
- 2016Structural distortions in the high-pressure polar phases of ammonium metal formatescitations
- 2016Stability of Fe,Al-bearing bridgmanite in the lower mantle and synthesis of pure Fe-bridgmanitecitations
- 2013Experimental evidence of orbital order in $α-B_{12} and γ-B_{28}$ polymorphs of elemental boroncitations
- 2011Electron-Deficient and Polycenter Bonds in the High-Pressure gamma-B-28 Phase of Boroncitations
- 2010Pressure-induced isostructural phase transformation in gamma-B(28)citations
- 2007Superhard nanocomposite of dense polymorphs of boron nitride: Noncarbon material has reached diamond hardnesscitations
Places of action
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article
Domain Auto Finder (DAFi) program: the analysis of single-crystal X-ray diffraction data from polycrystalline samples
Abstract
This paper presents the Domain Auto Finder (DAFi) program and its application to the analysis of single-crystal X-ray diffraction (SC-XRD) data from multiphase mixtures of microcrystalline solids and powders. Superposition of numerous reflections originating from a large number of single-crystal domains of the same and/or different (especially unknown) phases usually precludes the sorting of reflections coming from individual domains, making their automatic indexing impossible. The DAFi algorithm is designed to quickly find subsets of reflections from individual domains in a whole set of SC-XRD data. Further indexing of all found subsets can be easily performed using widely accessible crystallographic packages. As the algorithm neither requires a priori crystallographic information nor is limited by the number of phases or individual domains, DAFi is powerful software to be used for studies of multiphase polycrystalline and microcrystalline (powder) materials. The algorithm is validated by testing on X-ray diffraction data sets obtained from real samples: a multi-mineral basalt rock at ambient conditions and products of the chemical reaction of yttrium and nitrogen in a laser-heated diamond anvil cell at 50 GPa. The high performance of the DAFi algorithm means it can be used for processing SC-XRD data online during experiments at synchrotron facilities.