{"product_id":"9780191635069","title":"Electronic Structure Methods for Complex Materials: The orthogonalized linear combination of atomic orbitals","description":"Density functional theory (DFT) has blossomed in the past few decades into a powerful tool that is used by experimentalists and theoreticians alike. This book highlights the extensive contributions that the DFT-based OLCAO method has made to progress in this field, and it demonstrates its competitiveness for performing ab initio calculations on large and complex models of practical systems. A brief historical account and introduction to the elements of the theory set the stage for discussions on semiconductors, insulators, crystalline metals and alloys, complex crystals, non-crystalline solids and liquids, microstructure containing systems and those containing impurities, defects, and surfaces, biomolecular systems, and the technique of ab initio core level spectroscopy calculation.","brand":"OUP Oxford","offers":[{"title":"Default Title","offer_id":47072466600176,"sku":"9780191635069","price":93.49,"currency_code":"USD","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0737\/7593\/9824\/files\/9780191635069_p0.jpg?v=1769911119","url":"https:\/\/shop-qa.barnesandnoble.com\/products\/9780191635069","provider":"Barnes \u0026 Noble (DEV)","version":"1.0","type":"link"}