Results 21 to 30 of about 27,825 (256)

Thermodynamic calculations in ternary titanium–aluminium–manganese system [PDF]

Journal of the Serbian Chemical Society, 2008
Thermodynamic calculations in the ternary Ti–Al–Mn system are shown in this paper. The thermodynamic calculations were performed using the FactSage thermochemical software and database, with the aim of determining thermodynamic properties, such as ...
ANA I. KOSTOV, DRAGANA T. ZIVKOVIC
doaj   +3 more sources

Thermodynamic modeling of the Al–Cr–Mo–Ni system

AIP Advances, 2023
The Al–Cr–Mo–Ni system is of technical interest because it is an essential system for the thermodynamic modeling of systems related to the Ni- and NiAl-based superalloys.
Jian Peng, Wei Huang, Man Xu, Shulin Wang, Zhigang Xu, Wenjun Li, Junjun Wang, Chuanbin Wang, Peter Franke, Hans J. Seifert   +9 more
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Solidification Calculations of Precious Alloys and Al-Base Alloys for Additive Manufacturing

Metals, 2022
In this paper, we report two cases studies where solidification processes were successfully investigated with CALPHAD-based methodologies. The first one refers to the use of thermodynamic databases to describe the solidification processes of a precious ...
Federico Scaglione, Sergio Arnaboldi, Cristian Viscardi, Marcello Baricco, Mauro Palumbo   +4 more
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Linear Solvation–Energy Relationships (LSER) and Equation-of-State Thermodynamics: On the Extraction of Thermodynamic Information from the LSER Database

Liquids, 2023
There is a remarkable wealth of thermodynamic information in freely accessible databases, the LSER database being a classical example. The LSER, or Abraham solvation parameter model, is a very successful predictive tool in a variety of applications in ...
Costas Panayiotou, Ioannis Zuburtikudis, Hadil Abu Khalifeh, Vassily Hatzimanikatis   +3 more
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Idaho database of solution thermodynamics

Journal of Molecular Liquids, 2021
Abstract The “Idaho Database of Solution Thermodynamics” (IDST, https://idst.inl.gov/ ) was created by collecting literature vapor liquid equilibrium (VLE) data in the form of practical osmotic coefficients, ϕ m , and solute molal activity coefficients, γ B ( m ) , for binary solutions (solute-solvent).
Brendan P. Feeley, Michael A. Overton, Matthew M. Galloway, Thibaut J. Lecrivain, Aaron D. Wilson   +4 more
openaire   +1 more source

Thermodynamic database for multicomponent oxide systems

Chimica Techno Acta, 2018
A state-of-the-art thermodynamic database has been developed for multicomponent oxide systems. It can be used in combination with FactSage software to calculate the properties of metallurgical slags, glasses, ceramics, refractories, minerals, cements ...
S. A. Decterov
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A Data Resource for Prediction of Gas-Phase Thermodynamic Properties of Small Molecules

Data, 2022
The thermodynamic properties of a substance are key to predicting its behavior in physical and chemical systems. Specifically, the enthalpy of formation and entropy of a substance can be used to predict whether reactions involving that substance will ...
William Bains, Janusz Jurand Petkowski, Zhuchang Zhan, Sara Seager   +3 more
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Critical Evaluation and Thermodynamic Optimization of the Cu-Zn, Cu-Se and Zn-Se Binary Systems

Metals, 2022
In our study, a complete review of the literature, critical evaluation and thermodynamic assessment of the Cu-Zn, Cu-Se and Zn-Se binary systems were carried out.
Yu Tang, Jie Ma, Dong Han, Jian Wang, Haiying Qi, Liling Jin   +5 more
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First-principles thermodynamic modeling for the Al-Nb-Ni ternary system

Science and Technology of Advanced Materials: Methods
In CALPHAD methodology, used for thermodynamic database construction, the first-principles calculations based on the density functional theory have increasingly become important tool to provide an input data for assessing the thermodynamic database.
Arkapol Saengdeejing, Ryoji Sahara, Yoshiaki Toda   +2 more
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Thermodynamic Description of Ternary Fe-B-X Systems. Part 5: Fe-B-Si [PDF]

Archives of Metallurgy and Materials, 2019
Thermodynamic descriptions of the ternary Fe-B-Si system and its binary sub-system, B-Si, are developed in the context of a new Fe-B-X (X = Cr, Ni, Mn, V, Si, Ti, C) database.
J. Miettinen, V-V. Visuri, T. Fabritius, N. Milcheva, G. Vassilev   +4 more
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