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首页> 外文期刊>International Journal of Quantum Chemistry >Heat capacities, order-disorder transitions, and thermodynamic properties of rare-earth orthoferrites and rare-earth iron garnets
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Heat capacities, order-disorder transitions, and thermodynamic properties of rare-earth orthoferrites and rare-earth iron garnets

机译:稀土正铁氧体和稀土铁石榴石的热容,有序转变和热力学性质

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摘要

Rare-earth orthoferrites, RFeO3, and rare-earth iron garnets (RIGs) R3Fe5O12 (R = rare-earth elements) were prepared by citrate-nitrate gel combustion method and characterized by X-ray diffraction method. Isobaric molar heat capacities of these oxides were determined by using differential scanning calorimetry from 130 to 860 K. Order-disorder transition temperatures were determined from the heat capacity measurements. The Neel temperatures (T-N) due to antiferromagentic to paramagnetic transitions in orthoferrites and the Curie temperatures (T-C) due to ferrimagnetic to paramagnetic transitions in garnets were determined from the heat capacity data. Both T-N and T-C systematically decrease with increasing atomic number of R across the series. Lattice, electronic and magnetic contributions to the total heat capacity were calculated. Debye temperatures as a function of absolute temperature were calculated for these compounds. Thermodynamic functions like C-p,C-m degrees, S-m degrees, H degrees, G degrees, (H-T degrees - H-0 degrees), (H-T degrees - H-298.15K degrees), - (G(T)degrees - H-298.15K degrees) / T, Delta H-f(m)degrees, and Delta fG(m)degrees have been generated for the compounds RFeO3(S) and R3Fe5O12(s) based on the experimental data obtained in this study and the available data in the literature. (c) 2007 Elsevier Inc. All rights reserved.
机译:柠檬酸-硝酸盐凝胶燃烧法制备了稀土正铁酸盐,RFeO3和稀土铁石榴石(Rs)R3Fe5O12(R =稀土元素),并通过X射线衍射法进行了表征。这些氧化物的等压摩尔热容通过使用差示扫描量热法在130至860 K范围内确定。有序-无序转变温度由热容测量值确定。从热容量数据中确定了正铁素体中反铁磁转变为顺磁性的尼尔温度(T-N)和石榴石中铁磁转变为顺磁性的居里温度(T-C)。在整个系列中,T-N和T-C都随着R原子数的增加而系统地降低。计算出晶格,电子和磁性对总热容量的贡献。对于这些化合物,计算了作为绝对温度的函数的德拜温度。热力学函数,例如Cp,Cm度,Sm度,H度,G度,(HT度-H-0度),(HT度-H-298.15K度),-(G(T)度-H-298.15K基于本研究中获得的实验数据和文献中的可用数据,已针对化合物RFeO3(S)和R3Fe5O12(s)生成了度数/ T,ΔHf(m)度和ΔfG(m)度。 。 (c)2007 Elsevier Inc.保留所有权利。

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