Methods and application of the Paris–Edinburgh Press to X-ray diffraction structure solution with large-volume samples at high pressures and temperatures

Author(s):  
Wilson A. Crichton ◽  
Mohamed Mezouar
2001 ◽  
Vol 72 (2) ◽  
pp. 1302 ◽  
Author(s):  
Yanzhang Ma ◽  
Ho-kwang Mao ◽  
Russell J. Hemley ◽  
Stephen A. Gramsch ◽  
Guoyin Shen ◽  
...  

2008 ◽  
Vol 93 (9) ◽  
pp. 091907 ◽  
Author(s):  
I. A. Trojan ◽  
M. I. Eremets ◽  
S. A. Medvedev ◽  
A. G. Gavriliuk ◽  
V. B. Prakapenka

1998 ◽  
Vol 13 (12) ◽  
pp. 3458-3462 ◽  
Author(s):  
D. W. He ◽  
F. X. Zhang ◽  
X. Y. Zhang ◽  
Z. C. Qin ◽  
M. Zhang ◽  
...  

Carbon nitride crystals have been synthesized from C3N4H4 in the presence of a nickel-based alloy or cobalt as a catalyst at high pressure of 7 GPa and temperature of about 1400 °C. Scanning electron microscopy showed rod-like, well-faceted crystals with size of several micrometers, and the N content in these carbon nitride crystals was 47–62%. X-ray diffraction indicated the crystals were composed of α–C3N4 and β–C3N4. The experimental lattice constants of α–C3N4 (a = 6.425 Å, c = 4.715 Å ) and β–C3N4 (a = 6.419 Å, c = 2.425 Å ) agree with ab initio calculations very well.


2002 ◽  
Vol 718 ◽  
Author(s):  
Catherine A. McCammon ◽  
Ana Isabel Becerro ◽  
Stefan Lauterbach ◽  
Ulrich Bläß ◽  
Stefan Marion ◽  
...  

AbstractThe oxygen vacancy ordering process and displacive transitions have been characterised in the system CaTiO3-CaFeO2.5 as a function of composition and temperature at atmospheric pressure using X-ray diffraction, Mössbauer spectroscopy, infrared spectroscopy, transmission electron microscopy, electron energy loss spectroscopy, neutron diffraction and electrical conductivity methods. With increasing concentration of vacancies the following sequence is observed: isolated defects → short defect chains → infinite chains in layers. Similar experiments at high pressures and temperatures have been conducted to determine the nature of oxygen vacancies in the lower mantle phases (Mg,Fe)(Si,Al)O3-σ and Ca(Si,Fe)O3-σ perovskite.


2019 ◽  
Vol 88 ◽  
pp. 1-5 ◽  
Author(s):  
T.R. Cunha ◽  
A.D. Rodrigues ◽  
J.E. Rodrigues ◽  
D.V. Sampaio ◽  
B.J.A. Moulton ◽  
...  

IUCrJ ◽  
2021 ◽  
Vol 8 (2) ◽  
pp. 208-214
Author(s):  
Dominique Laniel ◽  
Bjoern Winkler ◽  
Egor Koemets ◽  
Timofey Fedotenko ◽  
Stella Chariton ◽  
...  

At high pressures, autoionization – along with polymerization and metallization – is one of the responses of simple molecular systems to a rise in electron density. Nitrosonium nitrate (NO+NO3 −), known for this property, has attracted a large interest in recent decades and was reported to be synthesized at high pressure and high temperature from a variety of nitrogen–oxygen precursors, such as N2O4, N2O and N2–O2 mixtures. However, its structure has not been determined unambiguously. Here, we present the first structure solution and refinement for nitrosonium nitrate on the basis of single-crystal X-ray diffraction at 7.0 and 37.0 GPa. The structure model (P21/m space group) contains the triple-bonded NO+ cation and the NO3 − sp 2-trigonal planar anion. Remarkably, crystal-chemical considerations and accompanying density-functional-theory calculations show that the oxygen atom of the NO+ unit is positively charged – a rare occurrence when in the presence of a less-electronegative element.


2010 ◽  
Vol 95 (11-12) ◽  
pp. 1708-1716 ◽  
Author(s):  
E. J. Tronche ◽  
M. van Kan Parker ◽  
J. de Vries ◽  
Y. Wang ◽  
T. Sanehira ◽  
...  

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