Homepage » ALL COURSE » College of Science » Department of Applied Chemistry » Physical Chemistry II | Department of Applied Chemistry Prof. Chao-Yuan Zhu
本課程是由 國立陽明交通大學應用化學系提供。
Introduction to quantum chemistry, molecular orbitals and bonding. The Schrodinger equation and its solutions for some simple systems. Wavefunctions, one-electron and multielectron atoms and molecules, rotation and vibration of molecules. Molecular orbitals and bonding in diatomic and polyatomic molecules. Molecular symmetry, structure, and spectroscopy.
Textbook:Physical Chemistry 3rd edition, Mortimer, 2008.
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| Instructor(s) | Department of Applied Chemistry Prof. Chao-Yuan Zhu | 
|---|---|
| Course Credits | 3 Credits | 
| Academic Year | 98 Academic Year | 
| Level | Second year university student | 
| Prior Knowledge | Physics, Chemistry, Applied Mathematics | 
| Related Resources | Course Video Course Syllabus Course Calendar | 
| Week | Course Content | Course Video | 
|---|---|---|
| 單元一 Origins of quantum mechanics Classical harmonic oscillator Classical wave Maxwell electromagnetic wave | Watch Online | |
| Blackbody radiation Photoelectric effect | Watch Online | |
| Hydrogen Atom | Watch Online | |
| 單元二 The Schrodinger wave equation Particle in one-dimensional box Particle in three-dimensional box Quantum harmonic oscillator | Watch Online | |
| 單元三 Quantum operators and observables Operator algebra Classical correspondence | Watch Online | |
| Particle on a ring Expectation and Interpretation of wave function | Watch Online | |
| The Heisenberg uncertainty principle | Watch Online | |
| Review (單元三) | Watch Online | |
| 單元四 The hydrogen atom Particle on a sphere Real function-angular momentum orbital The two-body central force system | Watch Online | |
| The Radial wave function of hydrogen like atoms | Watch Online | |
| Expectation value | Watch Online | |
| Orbital visualization | Watch Online | |
| 單元五 Approximation methods for multielectron atoms The Hamiltonian of helium like atoms Electron spin | Watch Online | |
| Pauli Exclusion Principle Addition of angular momentum | Watch Online | |
| Slater determinant Variation method | Watch Online | |
| Application to helium atom The perturbation method | Watch Online | |
| Application to lithium atom The Hartree-Fock self-consistent field method | Watch Online | |
| Atomic spectra | Watch Online | |
| 單元六 Diatomic molecules Hamiltonian for diatomic system Hydrogen molecule ion | Watch Online | |
| Molecular orbitals for homonuclear diatomic molecules Application of molecular orbitals | Watch Online | |
| General LCAO-MO Term symbols for homonuclear diatomic molecules | Watch Online | |
| Molecular orbitals for heteronuclear diatomic molecules Dipole moment and partial charge | Watch Online | |
| 單元七 Polyatomic molecules and chemical bonds Linear and non-linear triatomic systems | Watch Online | |
| Walsh diagram for triatomic systems Hybrid MOs and bond angles | Watch Online | |
| Summary (單元七) | Watch Online | |
| Hückel molecular orbitals | Watch Online | |
| 單元八 Translations, rotations and vibrations Introduction Translations | Watch Online | |
| Rotation and vibration of diatomic molecule Morse potential | Watch Online | |
| Rotation of polyatomic molecules Vibrations of polyatomic molecules | Watch Online | |
| The equilibrium populations of molecular states The ortho and para hydrogen molecule | Watch Online | |
| Summary (單元八) | Watch Online | 
課程目標
Introduction to quantum chemistry, molecular orbitals and bonding. The Schrodinger equation and its solutions for some simple systems. Wavefunctions, one-electron and multielectron atoms and molecules, rotation and vibration of molecules. Molecular orbitals and bonding in diatomic and polyatomic molecules. Molecular symmetry, structure, and spectroscopy.
課程章節
| 章節 | 章節內容 | 
| 單元一 | Origins of quantum mechanics | 
| 單元二 | The Schrodinger wave equation | 
| 單元三 | Quantum operators and observables | 
| 單元四 | The hydrogen atom | 
| 單元五 | Approximation methods for multielectron atoms | 
| 單元六 | Diatomic molecules | 
| 單元七 | Polyatomic molecules and chemical bonds | 
| 單元八 | Translations, rotations and vibrations | 
| 單元九 | Optical spectroscopy and photochemistry | 
| 單元十 | Magnetic resonance spectroscopy | 
| 單元十一 | Miscellaneous topics in quantum chemistry | 
課程書目
Physical Chemistry 3rd edition, Mortimer, 2008
[99學年第1學期 物理化學(三)也使用這本教科書]
參考書目
Physical Chemistry 2nd edition, Engel and Reid, Pearson 2010.
Physical Chemistry, McQuarrie and Simon, 1997.
Atkins Physical Chemistry 7th edition, Atkins and Paula, 2002.
評分標準
| 項目 | 百分比 | 
| 作業部分:每堂課後均有作業 | 20% | 
| Midterm-I | 15% | 
| Midterm-II | 20% | 
| Midterm-III | 15% | 
| 期末考 | 30% | 
本課程行事曆提供課程進度與考試資訊參考。
| 章節 | 章節內容 | 
| 單元一 | Origins of quantum mechanics | 
| 單元二 | The Schrodinger wave equation | 
| 單元三 | Quantum operators and observables | 
| 單元四 | The hydrogen atom | 
| 單元五 | Approximation methods for multielectron atoms | 
| 單元六 | Diatomic molecules | 
| 單元七 | Polyatomic molecules and chemical bonds | 
| 單元八 | Translations, rotations and vibrations | 
| 單元九 | Optical spectroscopy and photochemistry | 
| 單元十 | Magnetic resonance spectroscopy | 
| 單元十一 | Miscellaneous topics in quantum chemistry |