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首页> 外文期刊>International Journal of Quantum Chemistry >Pressure-temperature phase diagram of SeO2. Characterization of new phases
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Pressure-temperature phase diagram of SeO2. Characterization of new phases

机译:SeO2的压力-温度相图。新阶段的表征

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We have investigated SeO2 at high pressures and high temperatures. Two new phases (beta-SeO2 and gamma-SeO2) and the boundary separating them have been found, following experimental runs performed at pressures tip to 15 GPa and temperatures up to 820degreesC. The two phases crystallize in the orthorhombic system in space group Pmc2(1) (no. 26) with a = 5.0722(1) Angstrom, b = 4.4704(1) Angstrom, c = 7.5309(2) Angstrom, V = 170.760(9) Angstrom(3) and Z = 4 for the beta-phase, and with a = 5.0710(2) Angstrom, b = 4.4832(2) Angstrom, c = 14.9672(6) Angstrom, V = 340.27(3) Angstrom(3) and Z = 8 for the gamma-phase. Both phases are stable at ambient pressure and temperature below -30degreesC. At ambient temperature the phases return to the starting phase (alpha-SeO2) in a few days. We discuss our findings in relation to a previous report of in-situ measurements at high pressures and ambient temperature. (C) 2004 Elsevier Inc. All rights reserved.
机译:我们已经在高压和高温下研究了SeO2。在压力达到15 GPa和温度高达820°C的条件下进行实验后,发现了两个新的相(β-SeO2和γ-SeO2)以及将它们分开的边界。这两个相在空间群Pmc2(1)(编号26)的正交晶体系统中结晶,a = 5.0722(1)埃,b = 4.4704(1)埃,c = 7.5309(2)埃,V = 170.760(9 )β相的Angstrom(3)和Z = 4,并且a = 5.0710(2)Ang,b = 4.4832(2)Ang,c = 14.9672(6)Ang,V = 340.27(3)Angstrom(3 ),对于γ相,Z = 8。这两相在环境压力和低于-30摄氏度的温度下均稳定。在环境温度下,几天后相便回到起始相(α-SeO2)。我们讨论与高压和环境温度下的现场测量的先前报告有关的发现。 (C)2004 Elsevier Inc.保留所有权利。

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