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Materials studio quasi random4/7/2024 ![]() For example, a 6.6% volume change at ∼105 GPa appears during the transition of the B8 structure of MnO due to the Mott transition ( 1), a 2% volume change at 5.5 GPa occurs in the transition of hexagonal to the same structure ThAl 2 ( 2), and a 4.0–6.5% volume change appears in the transition of the orthorhombic perovskites of PrFeO 3, EuFeO 3, and LuFeO 3 to also orthorhombic structure around 50 GPa (where the transition is considered a high-spin to low-spin transition of the Fe ions) ( 3). Ordinarily, an isostructural phase transition is accomplished with a volume collapse without any symmetrical change. ![]() Phase transitions are one of the most fundamental research topics in physics, chemistry, bioscience, and geosciences. ![]()
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