Electronic Structures of Inorganic Materials 1

Numbering Code U-ENG25 35165 LJ75 Year/Term 2022 ・ First semester
Number of Credits 2 Course Type Lecture
Target Year Target Student
Language Japanese Day/Period Thu.2
Instructor name TANAKA ISAO (Graduate School of Engineering Professor)
Outline and Purpose of the Course Electron theory is essential for fundamental understanding of the relationship among properties, crystal structure and chemical composition in wide variety of inorganic crystals. This course provides an introduction to the basic electron theory to be used to describe the electronic structures of inorganic materials in general.
Course Goals This course provides an introduction to the basic electron theory to be used to describe the electronic structures of inorganic materials in general.
Schedule and Contents Introduction to quantum theory,3times,Description of electrons, Schroedinger equation
Electronic structures of isolated atoms,3times,hydrogen-like atoms, quantum numbers, many-electron atoms, self-consistent method, electron spin
Electronic structure of simple molecules,3times,molecular orbital method, homo/hetero nuclear diatomic molecules, chemical bondings
Electronic structures of crystals,4times,electronic structure of monoatomic crystals and binary compounds, 1D chain of hydrogen atoms, Bloch theorem, band calculations
Application to materials science,1time,Density functional theory calculations and their application to materials science
Assessment of mastery of the course content,1time,Assessment of mastery of the course content
Evaluation Methods and Policy Final exam.
Some quiz-sheets are distributed at the lecture whose answers should be submitted on site. Their scores may count as a portion (20%) of the cumulative grade.
Course Requirements Understanding of contents for Basic Phys. Chemistry(quantum theory) is preferred.
Study outside of Class (preparation and review) Support materials are available on KULASIS. Password is given in the lecture room.
They may be used for reviewing.
Textbooks Textbooks/References (In Japanese) Introduction to electron theory of materials, Isao TANAKA and others, , ISBN:10: 9784753655595
The textbook for this lecture (in Japanese) can be purchased at a bookstore.
References, etc. Elementary Quantum Chemistry, Frank L. Pilar, , ISBN:10: 0486414647
Inorganic Chemistry , Mark Weller, Tina Overton, Jonathan Rourke, , ISBN:10: 0198768125
Atkins' Physical Chemistry, Peter Atkins, Julio de Paula, James Keeler, , ISBN:10: 0198769865
Solid State Physics, Neil W. Ashcroft, , ISBN:10: 8131500527
Solid State Chemistry and its Applications , Anthony R. West, , ISBN:10: 1119942942
Electronic Structure: Basic Theory and Practical Methods, Richard M. Martin, , ISBN:10: 0521534402
Standard textbooks for elementary quantum physics, quantum chemistry, solid state chemistry and solid state physics may be used.
Related URL
PAGE TOP