LEADER 04253nam 22006855 450 001 9910254052603321 005 20200630035453.0 010 $a3-319-22951-6 024 7 $a10.1007/978-3-319-22951-5 035 $a(CKB)3710000000595321 035 $a(SSID)ssj0001584168 035 $a(PQKBManifestationID)16265327 035 $a(PQKBTitleCode)TC0001584168 035 $a(PQKBWorkID)14865135 035 $a(PQKB)10755798 035 $a(DE-He213)978-3-319-22951-5 035 $a(MiAaPQ)EBC6314711 035 $a(MiAaPQ)EBC5589174 035 $a(Au-PeEL)EBL5589174 035 $a(OCoLC)920873446 035 $a(PPN)190525835 035 $a(EXLCZ)993710000000595321 100 $a20150903d2016 u| 0 101 0 $aeng 135 $aurnn#008mamaa 181 $ctxt 182 $cc 183 $acr 200 10$aMagnetic Interactions in Molecules and Solids /$fby Coen de Graaf, Ria Broer 205 $a1st ed. 2016. 210 1$aCham :$cSpringer International Publishing :$cImprint: Springer,$d2016. 215 $a1 online resource (XVI, 246 p. 75 illus., 32 illus. in color.) 225 1 $aTheoretical Chemistry and Computational Modelling,$x2214-4714 300 $aIncludes Index. 311 $a3-319-22950-8 327 $a1. Basic Concepts -- 2. One Magnetic Center -- 3. Two (or more) Magnetic Centers -- 4. From Orbital Models to Accurate Predictions -- 5. Towards a Quantitative Understanding -- 6. Magnetism and Conduction. 330 $aThis textbook is the second volume in the Theoretical Chemistry and Computational Modeling series and aims to explain the theoretical basis of magnetic interactions at a level that will be useful for master students in physical, inorganic and organic chemistry. The book gives a treatment of magnetic interactions in terms of the phenomenological spin Hamiltonians that have been such powerful tools for chemistry and physics in the past half century, starting from the simple Heisenberg and Ising Hamiltonians and ending with Hamiltonians that include biquadratic, cyclic or anisotropic exchange. On the other hand, it also explains how quantum chemical methods, reaching from simple mean field methods to accurate models that include the effects of electron correlation and spin-orbit coupling, can help to understand the magnetic properties. Connecting the two perspectives is an essential aspect of the book, since it leads to a deeper understanding of the relation between physical phenomena and basic properties. It also makes clear that in many cases one can derive magnetic coupling parameters not only from experiment, but also from accurate ab initio calculations. The book starts with introducing a selection of basic concepts and tools. Throughout the book the text is interlarded with exercises, stimulating the students to not only read but also verify the assertions and perform (parts of) the derivations by themselves. In addition, each chapter ends with a number of problems that can be used to check whether the material has been understood. 410 0$aTheoretical Chemistry and Computational Modelling,$x2214-4714 606 $aChemistry, Physical and theoretical 606 $aInorganic chemistry 606 $aStructural materials 606 $aTheoretical and Computational Chemistry$3https://scigraph.springernature.com/ontologies/product-market-codes/C25007 606 $aInorganic Chemistry$3https://scigraph.springernature.com/ontologies/product-market-codes/C16008 606 $aStructural Materials$3https://scigraph.springernature.com/ontologies/product-market-codes/Z11000 615 0$aChemistry, Physical and theoretical. 615 0$aInorganic chemistry. 615 0$aStructural materials. 615 14$aTheoretical and Computational Chemistry. 615 24$aInorganic Chemistry. 615 24$aStructural Materials. 676 $a541.378 700 $ade Graaf$b Coen$4aut$4http://id.loc.gov/vocabulary/relators/aut$01059875 702 $aBroer$b Ria$4aut$4http://id.loc.gov/vocabulary/relators/aut 801 0$bMiAaPQ 801 1$bMiAaPQ 801 2$bMiAaPQ 906 $aBOOK 912 $a9910254052603321 996 $aMagnetic Interactions in Molecules and Solids$92509307 997 $aUNINA