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Documents dont le centre de recherche est "CRCT - Centre de recherche en calcul thermochimique"

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Nombre de documents: 30

A

Al-Maskari, S., Belisle, È., Li, X., Le Digabel, S., Nawahda, A., & Zhong, J. (avril 2016). Classification with quantification for air quality monitoring [Communication écrite]. 20th Pacific-Asia Conference on Advances in Knowledge Discovery and Data Mining (PAKDD 2016), Auckland, New Zealand. Lien externe

B

Bale, C. W., Bélisle, È., Chartrand, P., Decterov, S., Eriksson, G. E., Gheribi, A. E., Hack, K., Jung, I.-H., Kang, Y.-B., Melancon, J., Pelton, A., Petersen, S., Robelin, C., Sangster, J., Spencer, P. J., & Van Ende, M. A. (2016). FactSage thermochemical software and databases, 2010–2016. Calphad, 54, 35-53. Disponible

Bale, C. W., Belisle, È., Chartrand, P., Decterov, S., Eriksson, G. E., Gheribi, A. E., Hack, K., Jung, I.-H., Kang, Y.-B., Melancon, J., Pelton, A., Petersen, S., Robelin, C., Sangster, J., Spencer, P. J., & Van Ende, M. A. (février 2016). Reprint of: FactSage thermochemical software and databases, 2010-2016 (vol 54, pg 35, 2016) [Communication écrite]. Christopher W. Bale Symposium, Nashville, TN, USA (19 pages). Publié dans CALPHAD: Computer Coupling of Phase Diagrams and Thermochemistry, 55(1). Lien externe

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Gheribi, A. E., & Chartrand, P. (2016). Thermal conductivity of molten salt mixtures: theoretical model supported by equilibrium molecular dynamics simulations. Journal of Chemical Physics, 144(8), 12 pages. Lien externe

Gheribi, A. E., Autissier, E., Gardarein, J. L., & Richou, M. (2016). Thermal transport properties of multiphase sintered metals microstructures. The copper-tungsten system: Experiments and modeling. Journal of Applied Physics, 119(14), 8 pages. Lien externe

Gheribi, A. E., Harvey, J.-P., Bélisle, È., Robelin, C., Chartrand, P., Pelton, A., Bale, C. W., & Le Digabel, S. (2016). Use of a biobjective direct search algorithm in the process design of material science applications. Optimization and Engineering, 17(1), 27-45. Lien externe

Gheribi, A. E., Salanne, M., & Chartrand, P. (2016). Formulation of Temperature-Dependent Thermal Conductivity of NaF, -Na3AlF6, Na5Al3F14, and Molten Na3AlF6Supported by Equilibrium Molecular Dynamics and Density Functional Theory. Journal of Physical Chemistry C, 120(40), 22873-22886. Lien externe

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Hidayat, T., Shishin, D., Decterov, S., & Jak, E. (2016). Thermodynamic Optimization of the Ca-Fe-O System. Metallurgical and Materials Transactions B: Process Metallurgy and Materials Processing Science, 47(1), 256-281. Lien externe

J

Jak, E., Hidayat, T., Shishin, D., Mehrjardi, A. F., Chen, J., Decterov, S., & Hayes, P. (mai 2016). Integrated experimental and modelling research for non-ferrous smelting and recycling systems [Communication écrite]. 10th International Conference on Molten Slags, Fluxes and Salts (Molten 2016), Seattle, Washington. Lien externe

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Kang, Y.-B., & Chartrand, P. (2016). Calculation of property diagram as a zero-phase fraction line of auxiliary phase. Calphad-Computer Coupling of Phase Diagrams and Thermochemistry, 55, 69-75. Lien externe

Kang, Z., Robelin, C., He, M., & Chartrand, P. (2016). Thermodynamic evaluation and optimization of the (KF + YF₃), (KCl + YCl₃) and (YF₃ + YbF₃) binary systems. Journal of Chemical Thermodynamics, 98, 242-253. Lien externe

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Lin, C., Wang, S., Chen, G., Wang, K., Cheng, Z., Lu, X., & Li, C. (2016). Thermodynamic evaluation of the BaO-ZrO2-YO1.5 system. Ceramics International, 42(12), 13738-13747. Lien externe

M

Mezbahul-Islam, M., Bélanger, F., Chartrand, P., Jung, I.-H., & Coursol, P. (2016). Application of thermodynamic calculations to the pyro-refining process for production of high purity bismuth. Metallurgical and Materials Transactions B, 48(1), 73-90. Lien externe

O

Ouzilleau, P., Gheribi, A. E., & Chartrand, P. (2016). The graphitization temperature threshold analyzed through a second-order structural transformation. Carbon, 109, 896-908. Lien externe

Ouzilleau, P., Gheribi, A. E., Lindberg, D. K., & Chartrand, P. (2016). A Size-Dependent Thermodynamic Model for Coke Crystallites: The Carbon-Sulfur System Up to 2500 K (2227 °C). Metallurgical and Materials Transactions B, 47(3), 1817-1831. Lien externe

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Pelton, A., & Kang, Y.-B. (2016). Regarding “Sulfide Capacity in Ladle Slag at Steelmaking Temperatures,” C. Allertz, Du Sichen; MMTB 2015 December. Metallurgical and Materials Transactions B, 47(6), 3241-3243. Lien externe

R

Robelin, C. (2016). Models for the thermodynamic properties of molten salt systems: Perspectives for ionic liquids. Fluid Phase Equilibria, 409, 482-494. Lien externe

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Seifitokaldani, A., Gheribi, A. E., & Dollé, M. (2016). On the limitation of density functional theory (DFT) for the treatment of the anharmonicity in FCC metals. Solid State Communications, 247, 78-81. Lien externe

Seifitokaldani, A., Gheribi, A. E., Dollé, M., & Chartrand, P. (2016). Thermophysical properties of titanium and vanadium nitrides: Thermodynamically self-consistent approach coupled with density functional theory. Journal of Alloys and Compounds, 662, 240-251. Lien externe

Seifitokaldani, A., Gheribi, A. E., Phan, A. T., Chartrand, P., & Dollé, M. (2016). Important variation in vibrational properties of LiFePO4 and FePO4 induced by magnetism. Scientific Reports, 6(1), 1-10. Disponible

Shishin, D., Hidayat, T., Decterov, S., & Jak, E. (mai 2016). Thermodynamic modelling of liquid slag-matte-metal equilibria applied to the simulation of the Peirce-Smith converter [Communication écrite]. 10th International Conference on Molten Slags, Fluxes and Salts (Molten 2016), Seattle, Washington. Lien externe

Shishin, D., Prostakova, V., Jak, E., & Decterov, S. (2016). Critical Assessment and Thermodynamic Modeling of the Al-Fe-O System. Metallurgical and Materials Transactions B: Process Metallurgy and Materials Processing Science, 47(1), 397-424. Lien externe

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Thibodeau, É., Gheribi, A. E., & In-Ho, J. (2016). A structural molar volume model for oxide melts part I: Li2O-Na2O-K2O-MgO-CaO-MnO-PbO-Al2O3-SiO2 melts-binary systems. Metallurgical and Materials Transactions B, 47(2), 1147-1164. Lien externe

Thibodeau, É., Gheribi, A. E., & In-Ho, J. (2016). A structural molar volume model for oxide melts Part III: Fe oxide-containing melts. Metallurgical and Materials Transactions B, 47(2), 1187-1202. Lien externe

Thibodeau, É., Gheribi, A. E., & Jung, I.-H. (2016). A Structural Molar Volume Model for Oxide Melts Part II: Li2O-Na2O-K2O-MgO-CaO-MnO-PbO-Al2O3-SiO2 Melts—Ternary and Multicomponent Systems. Metallurgical and Materials Transactions B, 47(2), 1165-1186. Lien externe

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Wang, J., Jin, L., Chen, C., Rao, W., Wang, C., & Liu, X. (2016). Critical evaluation and thermodynamic optimization of the U-Pb and U-Sb binary systems. Journal of Nuclear Materials, 480, 216-222. Lien externe

Wang, J., Wang, K., Ma, C., & Xie, L. (2016). Critical evaluation and thermodynamic optimization of the (U plus Bi), (U plus Si) and (U plus Sn) binary systems. Journal of Chemical Thermodynamics, 92, 158-167. Lien externe

Wang, K., Robelin, C., Wu, Z., Li, C., Xie, L., & Chartrand, P. (2016). Thermodynamic description of the AgCl-CoCl₂-InCl₃-NaCl system. Journal of Alloys and Compounds, 663, 885-898. Lien externe

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Zhu, Z., Gharghouri, M. A., & Pelton, A. (2016). Thermodynamic modelling and in-situ neutron diffraction investigation of the (Nd + Mg + Zn) system. Journal of Chemical Thermodynamics, 94, 43-51. Lien externe

Zhu, Z., Gharghouri, M. A., Medraj, M., Lee, S. Y., & Pelton, A. (2016). Thermodynamic modelling and in-situ neutron diffraction investigation of the (Ce+Mg+Zn) system. Journal of Chemical Thermodynamics, 93, 242-254. Lien externe

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