物理化學(二)
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.
課程用書：Physical Chemistry 3rd edition, Mortimer, 2008.
為求學習成效完美，請購買課本！
| 授課教師 | 應用化學系 朱超原老師 |
|---|---|
| 課程學分 | 3學分 |
| 授課年度 | 98學年度 |
| 授課對象 | 大學二年級學生 |
| 預備知識 | 物理、化學、應用數學 |
| 課程提供 | 課程影音 課程綱要 課程行事曆 |
| 週次 | 課程內容 | 課程影音 | 課程下載 |
|---|---|---|---|
| 單元一 Origins of quantum mechanics Classical harmonic oscillator Classical wave Maxwell electromagnetic wave | 線上觀看 | MP4下載 | |
| Blackbody radiation Photoelectric effect | 線上觀看 | MP4下載 | |
| Hydrogen Atom | 線上觀看 | MP4下載 | |
| 單元二 The Schrodinger wave equation Particle in one-dimensional box Particle in three-dimensional box Quantum harmonic oscillator | 線上觀看 | MP4下載 | |
| 單元三 Quantum operators and observables Operator algebra Classical correspondence | 線上觀看 | MP4下載 | |
| Particle on a ring Expectation and Interpretation of wave function | 線上觀看 | MP4下載 | |
| The Heisenberg uncertainty principle | 線上觀看 | MP4下載 | |
| Review (單元三) | 線上觀看 | MP4下載 | |
| 單元四 The hydrogen atom Particle on a sphere Real function-angular momentum orbital The two-body central force system | 線上觀看 | MP4下載 | |
| The Radial wave function of hydrogen like atoms | 線上觀看 | MP4下載 | |
| Expectation value | 線上觀看 | MP4下載 | |
| Orbital visualization | 線上觀看 | MP4下載 | |
| 單元五 Approximation methods for multielectron atoms The Hamiltonian of helium like atoms Electron spin | 線上觀看 | MP4下載 | |
| Pauli Exclusion Principle Addition of angular momentum | 線上觀看 | MP4下載 | |
| Slater determinant Variation method | 線上觀看 | MP4下載 | |
| Application to helium atom The perturbation method | 線上觀看 | MP4下載 | |
| Application to lithium atom The Hartree-Fock self-consistent field method | 線上觀看 | MP4下載 | |
| Atomic spectra | 線上觀看 | MP4下載 | |
| 單元六 Diatomic molecules Hamiltonian for diatomic system Hydrogen molecule ion | 線上觀看 | MP4下載 | |
| Molecular orbitals for homonuclear diatomic molecules Application of molecular orbitals | 線上觀看 | MP4下載 | |
| General LCAO-MO Term symbols for homonuclear diatomic molecules | 線上觀看 | MP4下載 | |
| Molecular orbitals for heteronuclear diatomic molecules Dipole moment and partial charge | 線上觀看 | MP4下載 | |
| 單元七 Polyatomic molecules and chemical bonds Linear and non-linear triatomic systems | 線上觀看 | MP4下載 | |
| Walsh diagram for triatomic systems Hybrid MOs and bond angles | 線上觀看 | MP4下載 | |
| Summary (單元七) | 線上觀看 | MP4下載 | |
| Hückel molecular orbitals | 線上觀看 | MP4下載 | |
| 單元八 Translations, rotations and vibrations Introduction Translations | 線上觀看 | MP4下載 | |
| Rotation and vibration of diatomic molecule Morse potential | 線上觀看 | MP4下載 | |
| Rotation of polyatomic molecules Vibrations of polyatomic molecules | 線上觀看 | MP4下載 | |
| The equilibrium populations of molecular states The ortho and para hydrogen molecule | 線上觀看 | MP4下載 | |
| Summary (單元八) | 線上觀看 | MP4下載 |
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 |