{"product_id":"electronic-structure-calculations-for-solids-and-molecules-9780521815918","title":"Electronic Structure Calculations for Solids and Molecules","description":"\u003cb\u003eBook Synopsis\u003c\/b\u003e\u003cbr\u003eThis 2006 textbook for graduate students in physics and chemistry describes the theoretical approaches and computational techniques for studying the behavior of electrons. The first part covers the theoretical methods, including both density-functional theory and Hartree-Fock theory and the latter part discusses the different computational methods.\u003cbr\u003e\u003cbr\u003e\u003cb\u003eTable of Contents\u003c\/b\u003e\u003cbr\u003ePreface; List of symbols; List of acronyms; Part I. Theory: 1. The problem of the structure of matter; 2. The electronic problem; 3. Quantum many-body theory: chemical approaches; 4. Density function theory; 5. Exchange and correlation in DFT: approximation and their performance; Part II. Computational Methods: 6. Solving the electronic problem in practice; 7. Atomic pseudopotentials; 8. Basis sets; 9. Electronic structure methods; 10. Simplified approaches to the electronic problem; 11. Diagonalization and electronic self-consistency; 12. First-principles molecular dynamics (Car-Parrinello); Index.","brand":"Cambridge University Press","offers":[{"title":"Default Title","offer_id":51767742202199,"sku":"9780521815918","price":76.94,"currency_code":"GBP","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0817\/1739\/5799\/files\/9780521815918.jpg?v=1758714674","url":"https:\/\/bookcurl.com\/products\/electronic-structure-calculations-for-solids-and-molecules-9780521815918","provider":"Book Curl","version":"1.0","type":"link"}