{"product_id":"theoretical-aspects-and-computer-modeling-of-the-molecular-solid-state-hardback-9780471961871","title":"Theoretical Aspects and Computer Modeling of the Molecular Solid State (Hardback) 9780471961871","description":"\u003cfont face=\"Georgia\"\u003e\r\n\u003cp\u003e\u003cfont size=\"6\"\u003eTheoretical Aspects and Computer Modeling of the Molecular Solid State\u003c\/font\u003e\u003cbr\u003e\r\n\r\n\r\n\r\n\r\n\r\n\u003c\/p\u003e\n\u003cp\u003e\u003cfont size=\"4\"\u003eAngelo Gavezzotti (Edited by), A Gavezotti (Author)\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003e9780471961871, Wiley\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003eHardback, published 28 January 1997\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003e256 pages\u003cbr\u003e23.6 x 15.8 x 2 cm, 0.51 kg\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\r\n\r\n\r\n\r\n\u003cp align=\"justify\"\u003e\u003cstrong\u003e\u003cfont size=\"3\"\u003eThe theoretical aspects of crystal packing, the study of the nature and magnitude of the forces that hold molecules together in organic crystals, and of the most favourable arrangements of molecules in crystals are dealt with in this book. After an introductory chapter on the definition and relevance of symmetry in crystal packing, a chapter deals with the physical foundations of weak intermolecular forces and with their simulation by quantum chemical methods. Subsequently, the relationships between crystal structure and crystal thermodynamics are described using empirical intermolecular potentials to bridge the gap by computer modelling.\u003c\/font\u003e\u003c\/strong\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003eCrystal Symmetry and Molecular Recognition (A. Gavezzotti).\u003cbr\u003e \u003cbr\u003e Intermolecular Forces -\u003cbr\u003e From the Molecular Charge Distribution to the Molecular Packing (S. Price).\u003cbr\u003e \u003cbr\u003e Energetic Aspects of Crystal Packing: Experiment and Computer Simulations (A. Gavezzotti \u0026amp; G. Filippini).\u003cbr\u003e \u003cbr\u003e Energy Minimization and Molecular Dynamics Calculations for Molecular Crystals (B. van Eijck, et al.).\u003cbr\u003e \u003cbr\u003e Nucleation and Phase Transition in Molecular Clusters: Molecular Dynamics Simulation and Experiment (L. Bartell).\u003cbr\u003e \u003cbr\u003e Ab Initio Prediction of Possible Molecular Crystal Structures (R. Gdanitz).\u003cbr\u003e \u003cbr\u003e The Crystal Habit of Molecular Materials: A Structural Perspective (G. Clydesdale, et al.).\u003cbr\u003e \u003cbr\u003e Index.\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003eSubject Areas: Chemistry [\u003ca title=\"See our other books on Chemistry\" href=\"https:\/\/freshlyprintedbooks.co.uk\/search?q=%22Chemistry%20%5BPN%5D%22\"\u003ePN\u003c\/a\u003e]\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\r\n\u003c\/font\u003e","brand":"Wiley","offers":[{"title":"Brand New","offer_id":52316700606744,"sku":"9780471961871","price":301.39,"currency_code":"GBP","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0730\/2037\/5320\/files\/9780471961871.jpg?v=1781821941","url":"https:\/\/freshlyprintedbooks.co.uk\/products\/theoretical-aspects-and-computer-modeling-of-the-molecular-solid-state-hardback-9780471961871","provider":"Freshly Printed Books","version":"1.0","type":"link"}