{"product_id":"9783319110677","title":"SpringerBriefs in Molecular Science: The elongation method","description":"\u003ch1\u003eSpringerBriefs in Molecular Science: The elongation method\u003c\/h1\u003e \u003ch2\u003eGu, Feng Long; Aoki, Yuriko; Springborg, Michael; Kirtman, Bernard\u003c\/h2\u003e \u003cp\u003e\u003c\/p\u003e\u003cp\u003eFor design purposes one needs to relate the structure of proposed materials to their NLO (nonlinear optical) and other properties, which is a situation where theoretical approaches can be very helpful in providing suggestions for candidate systems that subsequently can be synthesized and studied experimentally. This brief describes the quantum-mechanical treatment of the response to one or more external oscillating electric fields for molecular and macroscopic, crystalline systems. To calculate NLO properties of large systems, a linear scaling generalized elongation method for the efficient and accurate calculation is introduced. The reader should be aware that this treatment is particularly feasible for complicated three-dimensional and\/or delocalized systems that are intractable when applied to conventional or other linear scaling methods.\u003c\/p\u003e \u003ch3\u003eDetails\u003c\/h3\u003e \u003cp\u003ePublished by: Springer\u003c\/p\u003e \u003cp\u003ePublication Date: 2014-12-03\u003c\/p\u003e \u003cp\u003eFormat: Paperback\u003c\/p\u003e \u003cp\u003eISBN-13: 9783319110677\u003c\/p\u003e \u003cp\u003eDOI: 10.1007\/978-3-319-11068-4\u003c\/p\u003e \u003cp\u003eDimensions: 235cm x155cm\u003c\/p\u003e \u003cp\u003ePages: 93\u003c\/p\u003e ","brand":"Springer International Publishing","offers":[{"title":"Default Title","offer_id":47400991326348,"sku":"9783319110677","price":49.49,"currency_code":"USD","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0710\/9545\/1788\/files\/9783319110677.jpg?v=1775788106","url":"https:\/\/fh90cf-fv.myshopify.com\/products\/9783319110677","provider":"Late Knight Books and Services, LLC","version":"1.0","type":"link"}