A chemist's guide to density functional theory. (2nd ed.)

• المؤلف الرئيسي: Koch, Wolfram. ; Holthausen, Max C.
• التنسيق: كتاب
• اللغة: English
• منشور في: Wiley-VCH 2020
• الموضوعات: Cấu trúc điện tử. ; Hóa học lượng tử > Toán học. ; Density functionals. ; Electronic structure. ; Quantum chemistry > Mathematics.; 541.28 KOC 2001
• الوصول للمادة أونلاين: http://repository.vnu.edu.vn/handle/VNU_123/92871

The Definition of the Model --|tElementary Quantum Chemistry --|tThe Schrodinger Equation --|tThe Variational Principle --|tThe Hartree-Fock Approximation --|tThe Restricted and Unrestricted Hartree-Fock Models --|tElectron Correlation --|tElectron Density and Hole Functions --|tThe Electron Density...