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胍酸钾水合物K·CHNO·HO的高压单晶X射线衍射研究。

A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K·CHNO·HO.

作者信息

Gaydamaka Anna A, Rashchenko Sergey V, Semerikova Anna I, Smirnova Ekaterina S, Ivanova Anna G, Arkhipov Sergey G, Zakharov Boris A, Bogdanov Nikita E, Boldyreva Elena V

机构信息

Novosibirsk State University, Pirogova Street 2, Novosibirsk, 630090, Russian Federation.

FSRC "Crystallography and Photonics" RAS, Leninskii Avenue 59, Moscow, 119333, Russian Federation.

出版信息

Acta Crystallogr B Struct Sci Cryst Eng Mater. 2023 Dec 1;79(Pt 6):495-509. doi: 10.1107/S2052520623008740. Epub 2023 Nov 2.

Abstract

The crystal structure of potassium guaninate hydrate, K·CHNO·HO, was studied in the pressure range of 1 atm to 7.3 GPa by single-crystal diffraction using synchrotron radiation and a laboratory X-ray diffraction source. Structural strain was compared to that of the same salt hydrate on cooling, and in 2Na·CHNO·7HO under hydrostatic compression and on cooling. A polymorphic transition into a new, incommensurately modulated, phase was observed at ∼4-5 GPa. The transition was reversible with a hysteresis: the satellite reflections disappeared on decompression to ∼1.4 GPa.

摘要

利用同步辐射和实验室X射线衍射源,通过单晶衍射在1个大气压至7.3吉帕的压力范围内研究了水合胍酸钾K·CHNO·HO的晶体结构。将结构应变与冷却时相同盐水合物以及静水压力下冷却时2Na·CHNO·7HO的结构应变进行了比较。在约4-5吉帕时观察到向一种新的、非公度调制相的多晶型转变。该转变是可逆的,存在滞后现象:减压至约1.4吉帕时卫星反射消失。

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