Computational Thermodynamic Calculations: FactSage from CALPHAD Thermodynamic Database to Virtual Process Simulation
Publication type: Journal Article
Publication date: 2020-08-03
scimago Q2
wos Q2
SJR: 0.585
CiteScore: 4.5
Impact factor: 3.1
ISSN: 10735615, 15431916
Materials Chemistry
Metals and Alloys
Condensed Matter Physics
Mechanics of Materials
Abstract
The CALPHAD-type computational thermodynamic databases have been developed since 1970. Several commercial computational thermodynamic software equipped with comprehensive and accurate thermodynamic databases and fast Gibbs energy minimization routine are widely used in the design of new materials and the optimization of materials processing. In this study, the FactSage software, which is the most frequently accessed software in high temperature materials processing, is briefly overviewed. The current databases and on-going directions of the thermodynamic database development are discussed. Application examples of FactSage thermodynamics databases to steel processing from the iron ore sintering process to the final metallic coating process are presented. Lastly, the most recent and future application of the FactSage thermodynamic databases to virtual steelmaking process simulations for the so-called industry 4.0 (smart factory) is highlighted.
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166
Total citations:
166
Citations from 2024:
87
(53.37%)
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GOST
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Jung I., Van Ende M. Computational Thermodynamic Calculations: FactSage from CALPHAD Thermodynamic Database to Virtual Process Simulation // Metallurgical and Materials Transactions B. 2020. Vol. 51. No. 5. pp. 1851-1874.
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Jung I., Van Ende M. Computational Thermodynamic Calculations: FactSage from CALPHAD Thermodynamic Database to Virtual Process Simulation // Metallurgical and Materials Transactions B. 2020. Vol. 51. No. 5. pp. 1851-1874.
Cite this
RIS
Copy
TY - JOUR
DO - 10.1007/s11663-020-01908-7
UR - https://doi.org/10.1007/s11663-020-01908-7
TI - Computational Thermodynamic Calculations: FactSage from CALPHAD Thermodynamic Database to Virtual Process Simulation
T2 - Metallurgical and Materials Transactions B
AU - Jung, In-Ho
AU - Van Ende, Marie-Aline
PY - 2020
DA - 2020/08/03
PB - ASM International
SP - 1851-1874
IS - 5
VL - 51
SN - 1073-5615
SN - 1543-1916
ER -
Cite this
BibTex (up to 50 authors)
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@article{2020_Jung,
author = {In-Ho Jung and Marie-Aline Van Ende},
title = {Computational Thermodynamic Calculations: FactSage from CALPHAD Thermodynamic Database to Virtual Process Simulation},
journal = {Metallurgical and Materials Transactions B},
year = {2020},
volume = {51},
publisher = {ASM International},
month = {aug},
url = {https://doi.org/10.1007/s11663-020-01908-7},
number = {5},
pages = {1851--1874},
doi = {10.1007/s11663-020-01908-7}
}
Cite this
MLA
Copy
Jung, In-Ho, and Marie-Aline Van Ende. “Computational Thermodynamic Calculations: FactSage from CALPHAD Thermodynamic Database to Virtual Process Simulation.” Metallurgical and Materials Transactions B, vol. 51, no. 5, Aug. 2020, pp. 1851-1874. https://doi.org/10.1007/s11663-020-01908-7.