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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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Kohlmann, Holger
Leipzig University
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (13/13 displayed)
- 2023Formation and Polymorphism of Semiconducting K$_2$SiH$_6$ and Strategy for Metallizationcitations
- 2022Hydrogen-induced order–disorder effects in FePd3citations
- 2021Mayenite-Based Electride C12A7e−: A Reactivity and Stability Study
- 2021Simultaneous neutron powder diffraction and Raman spectroscopy – an approach of combining two complementary techniques
- 2021Mayenite-based electride C12A7e⁻: an innovative synthetic method plasma arc melting
- 2020The crystal structure of ZrCr<sub>2</sub>D<sub>≈4</sub> at 50 K ≤ <i>T</i> ≤ 200 K
- 2019Hydrogenation Properties of LnAl2 (Ln = La, Eu, Yb), LaGa2, LaSi2 and the Crystal Structure of LaGa2H0.71(2)citations
- 2018Reversible hydrogenation of the Zintl phases BaGe and BaSn studied by in situ diffractioncitations
- 2016Crystal structures and hydrogenation properties of palladium-rich compounds with elements from groups 12–16citations
- 2014Synthesis and Crystal Structure of Pd5InSecitations
- 2010Structural isotope effects in metal hydrides and deuteridescitations
- 2010Crystal structure and formation of TlPd3 and its new hydride TlPd3Hcitations
- 2001Europium–Hydrogen Bond Distances in Saline Metal Hydrides by Neutron Diffractioncitations
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article
The crystal structure of ZrCr<sub>2</sub>D<sub>≈4</sub> at 50 K ≤ <i>T</i> ≤ 200 K
Abstract
<jats:title>Abstract</jats:title><jats:p>Many Laves phases take up considerable amounts of hydrogen to form metallic Laves phase hydrides. They frequently undergo phase transitions driven by ordering phenomena for the hydrogen atom distribution. The cubic Laves phase ZrCr<jats:sub>2</jats:sub> takes up hydrogen to form a hydride with almost four hydrogen atoms per formula unit, which undergoes a phase transition to a monoclinic modification at a critical temperature <jats:italic>T</jats:italic><jats:sub>c</jats:sub> = 250.2 K. Its crystal structure was refined based on neutron powder diffraction data on the deuteride (ZrCr<jats:sub>2</jats:sub>D<jats:sub>3.8</jats:sub> type [<jats:italic>T</jats:italic> = 1.6 K, <jats:italic>C</jats:italic>2/<jats:italic>c</jats:italic>]) at four temperatures in the range 50 K ≤ <jats:italic>T</jats:italic> ≤ 200 K. The monoclinic low-temperature modification features a strongly distorted square anti-prism ZrD<jats:sub>8</jats:sub> and three CrD<jats:sub>4</jats:sub> polyhedra with almost fully occupied deuterium sites in saddle-like, distorted tetrahedral and planar configurations. Zr–D distances are in the range 201.4(7) pm ≤ <jats:italic>d</jats:italic>(Zr–D) ≤ 208.5(8) pm and Cr–D distances in the range 172.9(7) pm ≤ <jats:italic>d</jats:italic>(Cr–D) ≤ 182.4(8) pm.</jats:p>