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Optimisation and Computation of Thermodynamic Properties and Phase Diagrams
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Advanced Theory and Simulation
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Academic year 2021/2022
- Teaching staff
- Prof. Marcello Baricco (Titolare del corso)
Prof. Mauro Palumbo (Titolare del corso)
Dr. Federico Scaglione (Titolare del corso) - Teaching period
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- Type
- Basic Other activities
- Course disciplinary sector (SSD)
- ING-IND/22 - materials science and technology
- Delivery
- Formal authority
- Language
- English
- Attendance
- Obligatory
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Sommario del corso
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Course objectives
The course is aimed to present the CALPHAD method for the optimization and calculation of thermodynamic properties and phase diagrams. Examples will be given for various systems, including aqueous solutions, semiconductors, oxides, metals and alloys, etc.
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Course delivery
The course is organized in theoretical lessons and practical computer applications. The course is planned in 1.5 days, for a total amount of 3 CFU.
Theoretical lessons: Monday June 6th, 2022, from 9 to 13
Practical applications: Monday June 6th, 2022, from 14 to 18
Practical applications: Tuesday June 7th, 2022, from 9 to 13
Lecture room Aula D1 - Department of Chemistry - Via P.Giuria 9, 10125 TORINO - 5th floor
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Learning assessment methods
After the course, students will be requested to provide a short report on possibile applications of learned topics in their research activities.
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Support activities
Registered students will need their personal laptop to attend the course.
Information on software download will be provided in the due time.
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Program
Theory (0.5 day)
Lecture 1: Thermodynamics and Phase Diagrams (M.Baricco)
Lecture 2: Ab initio modelling of thermodynamic properties: an
overview (M.Palumbo)
Lecture 3: The CALPHAD method (M.Baricco)
Computer applications (1.0 day) (M.Baricco, M.Palumbo,
F.Scaglone)
Calculations of phase diagrams. Application to industrial problems.Suggested readings and bibliography
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Note
Exact location will be announced in due time.
Students must register at the course web page. The maximum number of students is limited to 20.
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