Thermodynamic Calculations of the Production of Ferrovanadium from V-containing Steelworks Slags with a low Content of V2O5. Part 1

2008 ◽  
Vol 153 (3) ◽  
pp. 109-115
Author(s):  
H. Antrekowitsch ◽  
S. Luidold ◽  
H. Gaugl
Keyword(s):  
Thermodynamic Calculations

Thermodynamic calculations of linear chain molecules using a SAFT model

2001 ◽  
Vol 99 (1) ◽  
pp. 65-76 ◽  
Author(s):  
Yiping Tang, Zhaohui Wang, Benjamin C.-Y.
Keyword(s):  
Linear Chain ◽  
Thermodynamic Calculations ◽  
Chain Molecules

Coupled Mass and Heat Transport Models for Nuclear Fuels using Thermodynamic Calculations

2018 ◽  
Author(s):  
Srdjan Simunovic ◽  
Jake W. Mcmurray ◽  
Theodore M. Besmann ◽  
Emily Moore ◽  
Markus H. A. Piro
Keyword(s):  
Heat Transport ◽  
Thermodynamic Calculations ◽  
Nuclear Fuels ◽  
Transport Models

scholarly journals The stability and electronic and photocatalytic properties of the ZnWO4 (010) surface determined from first-principles and thermodynamic calculations

RSC Advances ◽  
2021 ◽  
Vol 11 (38) ◽  
pp. 23477-23490
Author(s):  
Yonggang Wu ◽  
Jihua Zhang ◽  
Bingwei Long ◽  
Hong Zhang
Keyword(s):  
Phase Diagram ◽  
Density Functional Theory ◽  
First Principles ◽  
Density Functional ◽  
Thermodynamic Calculations ◽  
Photocatalytic Properties ◽  
Thermodynamic Approach ◽  
Functional Theory ◽  
Stability Phase Diagram ◽  
The Stability

The ZnWO4 (010) surface termination stability is studied using a density functional theory-based thermodynamic approach. The stability phase diagram shows that O-Zn, DL-W, and DL-Zn terminations of ZnWO4 (010) can be stabilized.

A computational interface for thermodynamic calculations software MTDATA

Calphad ◽  
2008 ◽  
Vol 32 (1) ◽  
pp. 129-134 ◽  
Author(s):  
Zhiheng Huang ◽  
Paul P. Conway ◽  
Rachel C. Thomson ◽  
Alan T. Dinsdale ◽  
Jim A.J. Robinson
Keyword(s):  
Thermodynamic Calculations

Thermodynamic calculations in the development of high-temperature Co–Re-based alloys

2014 ◽  
Vol 582 ◽  
pp. 50-58 ◽  
Author(s):  
Bronislava Gorr ◽  
Hans-Jürgen Christ ◽  
Debashis Mukherji ◽  
Joachim Rösler
Keyword(s):  
High Temperature ◽  
Thermodynamic Calculations

Application of Thermodynamic Calculations to the Pyro-refining Process for Production of High Purity Bismuth

2016 ◽  
Vol 48 (1) ◽  
pp. 73-90 ◽  
Author(s):  
Mohammad Mezbahul-Islam ◽  
Frederic Belanger ◽  
Patrice Chartrand ◽  
In-Ho Jung ◽  
Pascal Coursol
Keyword(s):  
High Purity ◽  
Refining Process ◽  
Thermodynamic Calculations

scholarly journals Interval analysis for thermodynamic calculations in process design: a novel and completely reliable approach

1999 ◽  
Vol 158-160 ◽  
pp. 607-615 ◽  
Author(s):  
James Z Hua ◽  
Robert W Maier ◽  
Stephen R Tessier ◽  
Joan F Brennecke ◽  
Mark A Stadtherr
Keyword(s):  
Interval Analysis ◽  
Process Design ◽  
Thermodynamic Calculations

Effect of rare earth on inclusion evolution in industrial production of HRB500E steel

2021 ◽  
Vol 118 (2) ◽  
pp. 220
Author(s):  
Jian Kang ◽  
Yan-Chong Yu ◽  
Jin-Ling Zhang ◽  
Chao Chen ◽  
She-Bin Wang
Keyword(s):  
Free Energy ◽  
Rare Earth ◽  
Gibbs Free Energy ◽  
Industrial Production ◽  
Transformation Model ◽  
Thermodynamic Calculations ◽  
Smelting Process ◽  
Number Density ◽  
Complex Inclusion ◽  
Plant Trials

The effect of rare earth (RE) on inclusion in HRB500E steel was studied based on plant trials. The results showed that S decreased by 47.6% after 0.0059% RE treatment. In samples without RE treatment, the inclusions change from Al2O3-MnO to ellipsoidal Al2O3-MnO-CaO complex inclusion, and the size of such inclusions is ≤ 2 µm and isolated strip MnS inclusion with the size of ≥ 2 µm. With RE treatment, Al2O3-MnO-CaO inclusions are transformed into spherical or ellipsoidal REAlO3 and REAlO3-MnS. The size of such inclusions is ≈ 1.5 µm and single MnS inclusions were not found. The number density and size of inclusions changed significantly after RE treatment. Thermodynamic calculations show that the Gibbs free energy of RE inclusions is more negative and more stable. The transformation model of inclusions is established to illustrate the modification of inclusions during the smelting process.

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