Coupled Phase Diagram‐Thermodynamic Analysis of the 24 Binary Systems, A2CO3‐AX and A2SO4‐AX Where A=Li, Na, K and X=Cl, F, NO3, OH

1990 ◽  
Vol 19 (5) ◽  
pp. 1149-1178 ◽  
Author(s):  
Yves Dessureault ◽  
James Sangster ◽  
Arthur D. Pelton
Keyword(s):  
Phase Diagram ◽  
Thermodynamic Analysis ◽  
Binary Systems

Thermodynamic Analysis of the Fe-Mn-P Ternary Phase Diagram by Combining the First-Principles and CALPHAD Methods

2007 ◽  
Vol 561-565 ◽  
pp. 1899-1902 ◽  
Author(s):  
T. Tokunaga ◽  
N. Hanaya ◽  
Hiroshi Ohtani ◽  
Mitsuhiro Hasebe
Keyword(s):  
Experimental Data ◽  
Phase Diagram ◽  
Ternary System ◽  
Thermodynamic Analysis ◽  
First Principles ◽  
Binary Systems ◽  
Ternary Phase ◽  
Ternary Phase Diagram ◽  
First Principles Calculations ◽  
The Enthalpy Of Formation

A thermodynamic analysis of the Fe-Mn-P ternary system has been carried out using the CALPHAD method. Among the three binary systems relevant to this ternary phase diagram, the thermodynamic parameters of the Mn-P binary system were evaluated in this study. The enthalpy of formation of the binary phosphides obtained from our first-principles calculations was utilized in the present analysis to compensate for the lack of available experimental data. The thermodynamic descriptions of the Fe-Mn and Fe-P binary systems were taken from previous studies. The phase equilibria in the Fe-Mn-P ternary system were analysed based on the experimental data on the phase boundaries. The calculated phase diagrams are in agreement with the experimental results.

Calculation of phase diagrams and thermodynamic properties of 14 additive and reciprocal ternary systems containing Li2CO3, Na2CO3, K2CO3, Li2SO4, Na2SO4, K2SO4, LiOH, NaOH, and KOH

1984 ◽  
Vol 62 (3) ◽  
pp. 457-474 ◽  
Author(s):  
A. D. Pelton ◽  
C. W. Bale ◽  
P. L. Lin
Keyword(s):  
Phase Diagram ◽  
Thermodynamic Properties ◽  
Molten Salt ◽  
Phase Diagrams ◽  
Binary Systems ◽  
Ternary Phase ◽  
Ternary Phase Diagram ◽  
Ternary Systems ◽  
Maximum Error ◽  
Critical Assessment

Phase diagrams and thermodynamic properties of five additive molten salt ternary systems and nine reciprocal molten salt ternary systems containing the ions Li+, Na+, [Formula: see text], OH− are calculated from the thermodynamic properties of their binary subsystems which were obtained previously by a critical assessment of the thermodynamic data and the phase diagrams in these binary systems. Thermodynamic properties of ternary liquid phases are estimated from the binary properties by means of the Conformal Ionic Solution Theory. The ternary phase diagrams are then calculated from these thermodynamic properties by means of computer programs designed for the purpose. It is found that a ternary phase diagram can generally be calculated in this way with a maximum error about twice that of the maximum error in the binary phase diagrams upon which the calculations are based. If, in addition, some reliable ternary phase diagram measurements are available, these can be used to obtain small ternary correction terms. In this way, ternary phase diagram measurements can be smoothed and the isotherms drawn in a thermodynamically correct way. The thermodynamic approach permits experimental data to be critically assessed in the light of thermodynamic principles and accepted solution models. A critical assessment of error limits on all the calculated ternary diagrams is made, and suggestions as to which composition regions merit further experimental study are given.

Thermodynamic phase diagram analysis of three binary systems shared by five neopentane derivatives

Calphad ◽  
1994 ◽  
Vol 18 (4) ◽  
pp. 387-396 ◽  
Author(s):  
D.O. López ◽  
J. Van Braak ◽  
J.L.L. Tamarit ◽  
H.A.J. Oonk
Keyword(s):  
Phase Diagram ◽  
Binary Systems ◽  
Thermodynamic Phase Diagram ◽  
Thermodynamic Phase ◽  
Diagram Analysis

scholarly journals T-x-диаграмма системы Ga – Se в диапазоне составов 48.0 – 61.5 мол. % Se по данным термического анализа

2019 ◽  
Vol 21 (4) ◽  
pp. 519-527
Author(s):  
Andrew V. Kosyakov ◽  
Ivan N. Nekrylov ◽  
Nikolai Yu. Brezhnev ◽  
Ekaterina N. Malygina ◽  
Alexander Yu. Zavrazhnov
Keyword(s):  
Phase Diagram ◽  
Phase Equilibria ◽  
Binary Systems ◽  
Nauk Sssr ◽  
Doklady Akademii Nauk Sssr ◽  
Composition Control ◽  
Volatile Solids ◽  
M Phase ◽  
Manometric Method ◽  
And Diffusion

Целью настоящей работы было термографическое исследование T-x диаграммы системы Ga – Se в диапазоне температур от 500 до 1100 °С и в диапазоне составов от 48.0 до 61.5 mol % Se. Методом исследования являлся дифференциальный термический анализ c компьютерной регистрацией данных. Получены свидетельства о наличии ретроградного солидуса фазы g-GaSe со стороны селена (с областью гомогенности в несколько десятых mol % при температурах выше эвтектической) и о независимом существовании близких по составу фаз e-GaSe и g-GaSe. При этом более богатая галлием фаза e-GaSe испытывает перитектический распад с образованием расплава (L2) и g-GaSe. Для темпера-туры предполагаемой перитектической реакции получено значение 921 ±2 °С. Вместе стем, на данном этапе работ не получено никаких данных в пользу существования ожидавшейся (по аналогии с системой Ga – S) высокотемпературной модификации, близкой по составу к сесквиселениду галлия (Ga2S3). Другие результаты, полученные в настоящей работе (характер и температуры плавления промежуточных фаз, температуры эвтектического и монотектического превращений, а также координата эвтектического состава), хорошо согласуются с литературными данными по исследованной системе         ЛИТЕРАТУРА1. Kainzbauer P., Richter K. W., Ipser H. The binary Bi-Rh phase diagram: stable and metastable phases //J. Phase Equilibria and Diffusion, 2018, v. 39(1), pp. 17– 34. DOI: https://doi.org/10.1007/s11669-017-0600-52. Dolyniuk J.-A., Kaseman D. C., Sen S., Zhao J., Osterloh F. E., Kovnir K. mP-BaP3: A new phase froman old binary system // Chem. Eur. J., 2014, v. 20, pp. 10829–10837, DOI: https://doi.org/10.1002/chem.2013050783. Березин С. С., Завражнов А. Ю., Наумов А. В., Некрылов И. Н., Брежнев Н. Ю. Фазовая диаграммасистемы Ga–S в области 48.0–60.7 мол. % S // Конденсированные среды и межфазные границы, 2017,т. 19(3), с. 321–335. DOI: https://doi.org/10.17308/kcmf.2017.19/2084. Волков В. В., Сидей В. И., Наумов А. В., Некрылов И. Н., Брежнев Н. Ю., Малыгина Е. Н., Завражнов А. Ю. Высокотемпературная кубическая модификация сульфида галлия (Xs = 59 мол. %) и Т, х-диаграмма системы Ga – S // Конденсированные среды и межфазные границы, 2019, т. 21(1), с. 37–50.DOI: https://doi.org/10.17308/kcmf.2019.21/7155. Zavrazhnov A., Berezin S., Kosyakov A., Naumov A., Berezina M., Brezhnev N. J. The phase diagramof the Ga–S system in the concentration range of 48.0–60.7 mol % S // Thermal Analysis and Calorimetry,2018, v. 134(1), pp. 483–492. DOI: https://doi.org/10.1007/s10973-018-7124-z6. Okamoto H. Ga–Se (Gallium-Selenium) // J. Phase Equilibria and Diffusion, 2009, v. 30, p. 658. DOI:https://doi.org/10.1007/s11669-009-9601-37. Dieleman J., Sanders F. H. M. Phase diagram of the Ga-Se system // Phillips J. Res., 1982, v. 37(4),pp. 204 – 229.8. Zavrazhnov A. Yu. Turchen D. N., Goncharov Eu. G., Zlomanov V. P. Manometric method for thestudy of P-T-x diagrams // J. Phase Equilibria and Diffusion, 2001, v. 22(4), pp. 482–490. DOI: https://doi.org/10.1361/1054971017703330639. Shtanov V. I, Komov A. A, Tamm M. E., Atrashenko D. V., Zlomanov V. P. Gallium-selenium systemphase diagram and photoluminescence spectra of GaSe crystals // Doklady Akademii nauk SSSR, 1998, v. 361(3),pp. 357–361. (in Russ.)10. Glazov V. M., Pavlova L. M. Semiconductor and metal binary systems. Phase equilibria and chemicalthermodynamics. Springer, 1989, 327 p. DOI: https://doi.org/10.1007/978-1-4684-1680-011. Ider M. Pankajavalli R., Zhuang W. Thermochemistry of the Ga–Se System. J. Solid State Scienceand Techn., 2015, v. 4(5), Q51–Q60 DOI: https://doi.org/10.1149/2.0011507jss12. Zavrazhnov A., Naumov A., Sidey V., Pervov V. Composition control of low-volatile solids throughchemical vapor transport reactions. III. The example of gallium monoselenide: Control of the polytypicstructure, non-stoichiometry and properties // Thermochimica Acta, 2012, v. 527, pp. 118–124. DOI:https://doi.org/10.1016/j.tca.2011.10.012

Phase Diagram of the System LaCl3-CaCl2-NaCl

1987 ◽  
Vol 42 (12) ◽  
pp. 1421-1424 ◽  
Author(s):  
K. Igarashi ◽  
H. Ohtani ◽  
J. Mochinaga
Keyword(s):  
Phase Diagram ◽  
Ternary System ◽  
Phase Diagrams ◽  
Binary Systems ◽  
Eutectic Point ◽  
Peritectic Point

The phase diagram of ternary system LaCl3-CaCl2-NaCl has been constructed from the phase diagrams of the three binary systems and of thirteen quasi-binary systems determined by DTA. For the binaries LaCl3-CaCl2 and CaCl2-NaCl eutectic points were observed at 651 °C , 35.1 mol% LaCl3 and at 508 °C , 49.9 mol% NaCl, respectively. For LaCl3-NaCl, a peritectic point besides the eutectic point at 545 °C , 36.1 mol% LaCl3 was found at 690 °C , 57.5 mol%, which is attributable to the formation of the peritectic compound 3 LaCl3 · NaCl. The phase diagram of the ternary system has a ternary eutetic point and a ternary peritectic point due to 3 LaCl3-NaCl, the form er at 462 °C and 12.1 - 3 9 .7 - 4 8 .2 mol% (LaCl3-CaCl2-NaCl) and the latter at 612 °C and 26.9 - 55.1 - 18.0 mol%.

scholarly journals Thermodynamic Analysis of the Sn-In-Sb Ternary Phase Diagram

1999 ◽  
Vol 63 (6) ◽  
pp. 695-701 ◽  
Author(s):  
Satoru Ishihara ◽  
Hiroshi Ohtani ◽  
Takashi Saito ◽  
Kiyohito Ishida
Keyword(s):  
Phase Diagram ◽  
Thermodynamic Analysis ◽  
Ternary Phase ◽  
Ternary Phase Diagram
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