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- 工学院，物質理工学院，環境・社会理工学院共通科目
- Liberal arts and basic science courses
- First-Year Courses
- School of Science
- School of Engineering
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- School of Computing
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School of Environment and Society
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- Graduate major in Technology and Innovation Management
- Common courses
- Liberal arts and basic science courses
- Academic unit or major
- Graduate major in Chemical Science and Engineering
- Instructor(s)
- Kawauchi Susumu
- Class Format
- Lecture
- Media-enhanced courses
- Day/Period(Room No.)
- Mon5-6(南4号館 , 情報ネットワーク演習室 第２演習室)
- Group
- -
- Course number
- CAP.P424
- Credits
- 1
- Academic year
- 2017
- Offered quarter
- 4Q
- Syllabus updated
- 2017/3/17
- Lecture notes updated
- -
- Language used
- Japanese
- Access Index
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Course description and aims
This course introduces the molecular interactions governing the structure of soft materials including liquid crystals, polymeric materials, and supermolecules. This lecture provides how to use quantum chemical calculations and exercises．
Student learning outcomes
At the end of this course, students will be able to:
1) Explain kinds of molecular interactions and their origin based on quantum mechanics.
2) Explain how the molecular interactions act on the structure formation and control of soft materials.
3) Carry out the quantum chemistry calculations.
Keywords
Soft materials, intermolecular interaction, intramolecular interaction, supermolecules, quantum chemical calculation
Competencies that will be developed
| ✔ Specialist skills | Intercultural skills | Communication skills | Critical thinking skills | ✔ Practical and/or problem-solving skills |
Class flow
This course covers applications of quantum chemical calculations. Students report the related problems for understanding.
Course schedule/Required learning
| Course schedule | Required learning | |
|---|---|---|
| Class 1 | Soft materials and molecular interactions | Explain soft materials and molecular interactions. |
| Class 2 | Structure organization caused by intra- and intermolecular interactions | Explain structure organization caused by intra- and intermolecular interactions. |
| Class 3 | Basics and methods of quantum chemical calculations: geometry optimization and frequency calculation | Explain methods of quantum chemical calculations. |
| Class 4 | Quantum chemical calculations of intermolecular interaction | Carry out quantum chemical calculations on intermolecular interaction. |
| Class 5 | Quantum chemical calculations of UV-Visible spectra | Carry out quantum chemical calculations of UV-Visible spectra. |
| Class 6 | Exercise 1 of quantum chemical calculations | Carry out quantum chemical calculations on exercise. |
| Class 7 | Exercise 2 of quantum chemical calculations | Carry out quantum chemical calculations on exercise. |
Textbook(s)
Reference notes will be presented via OCW-i before the respective classes.
Reference books, course materials, etc.
None required.
Assessment criteria and methods
Report will be assessed according to the fulfilment degrees of the respective subjects.
Related courses
- CAP.P424 ： Advanced Polymer Structures II
Prerequisites (i.e., required knowledge, skills, courses, etc.)
No prerequisites are necessary.
