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最弱受約束電子理論及應用(英文版)(精)

  • 作者:鄭能武|責編:季英明|譯者:花蘭
  • 出版社:上海科技
  • ISBN:9787547861981
  • 出版日期:2023/06/01
  • 裝幀:精裝
  • 頁數:215
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內容大鋼
    本書系統詳盡地介紹了一種新的量子理論——最弱受約束電子理論(WBE Theory)。闡明如何從逐級電離和全同粒子角度,將體系哈密頓算符劃分成單電子哈密頓算符的兩種等效方法;如何從給定的解析式,嚴格求解單電子薛定諤方程,得到能量和波函數的解析表達式;如何處理分子問題等。用大量示例展現該理論在物理學、化學、材料科學中的應用,以表明其準確性、簡便性和普適性,並指出未來的研究方向和前景。

作者介紹
鄭能武|責編:季英明|譯者:花蘭
    鄭能武,福建省武夷山市(原崇安縣)人。北京大學化學系本科(六年制)畢業。中國科學技術大學教授、博士生導師,享受國務院政府特殊津貼。主要貢獻有:在國際上首次提出新的量子理論(WBE Theory),並發現元素電離能差分定律。出版中英文專著3郜、教材和教學參考書5部(與他人合作),撰寫科普著作4部。在國內外著名學術刊物發表論文百余篇,其中,被SCI收錄計73篇。曾任中國科技大學應用化學繫系主任、校學術委員會委員、校學位委員會委員。曾以教授身份應邀訪問美國普渡(Purdue)大學。

目錄
1 The Basics of Quantum Mechanics for the Weakest Bound
  Electron(WBE)Theory
  1.1  The Wave Particle Duality
  1.2  The Uncertainty Principle
  1.3  The Schrodinger Equation
  1.4  Electron Spin and Spin Orbital(3,6-8)
  1.5  The Indistinguishability of Micro Identical Particles
  1.6  Pauli Exclusion Principle and Periodic Table
  1.7  One of the Approximation Methods in Quantum
  Mechanics-The Variation Method
  References
2 The Weakest Bound Electron Theory(1)
  2.1  TheConceptoftheWeakestBoundElectron
  2.2  Ionization Process and Aufbau-Like Process is Reversible
  2.3  The One-Electron Hamiltonian for the Weakest BoundElectron
    2.3.1  The Non-Relativistic One-Electron Hamiltonianforthe Weakest Bound Electron
    2.3.2  The Treatment of Magnetic Interaction BetweenElectrons
    2.3.3  Relativistic Hamiltonian
  2.4  The One.Electron Schrodinger Equation of the Weakest Bound Electron
  2.5  TheKeyPoints oftheWBETheory
  References
3 TheWeakestBoundElectronTheory(2)
  3.1  Potential Function
  3.2  The Solution ofthe Radial Equation
    3.2.1  Spherical Harlnonic
    3.2.2  Generalized Laguerre Functions
    3.2.3  Restore the Form of Hydrogen and Hydrogen Like Atoms
    3.2.4  The Definition and Properties of Generalized Laguerre Functions
    3.2.5  The Proof of the Satisfaction of Hellmann-Feynman Theorem
  3.3  Matrix Element and Mean Value of Radial Operator rk
  3.4  The Exact Solutions of Scattering States in WBEPM Theorv
  3.5  The Formula for the Calculation of Fine Structure
  3.6  Calculation of Spin-Orbit Coupling Coefficient
  3.7  Relation Between the WBEPM Theory and Slater-TyDe
  Orbitals
  References
4 The Application ofthe WBE Theory
  4.1  Ionization Energy(1-10)
    4.1.1  Introduction
    4.1.2  Iso-spectrum-level Series and the Differential Law of Ionization Energy in the Series
    4.1.3  Calculation ofIonization Energy
    4.1.4  The Successive Ionization Energies of the 4f Electrons for the Lanthanides(10)
  4.2  Energy Level(39-50)
    4.2.1  Introduction
    4.2.2  FormulaeforCalculatingEnergyLevels
    4.2.3  Methods for Parameter Characterization
    4.2.4  Examples
  4.3  Calculation of Oscillator Strength,Transition Probability
    and Radiative Lifetime(88-104)
    4.3.1  Introduction

    4.3.2  Theory and Method for Calculation
    4.3.3  Examples
  4.4  Calculation of Total Electron Energy(1-159)
    4.4.1  Calculation of Total Electron Energy of the System Using Ionization Energy
    4.4.2  Variational Treatment on the Energy
    of the He-Sequence Ground State with the WBEP Theory
    4.4.3  Perturbation Treatment on the Energy
    of the He-Sequence Ground State with the WBEPM Theory(160)
  4.5  Electronegativity,Hard and Soft Acids and Bases
    and the Molecular Design of Coordination Polymers
    4.5.1  TheElectronegativityConceptand Scale
    4.5.2  The Nuclear Potential Scale of the Weakest Bound
    Electron(185,200)
    4.5.3  The Hard-Soft-Acid.Base Concept and Scale
    4.5.4  Molecular Design of Coordination Polymers
  References
Representation Publications
Postscript
Index

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