Theoretical aspects and computer modeling of the molecular solid state

＜図書＞
Theoretical aspects and computer modeling of the molecular solid state

責任表示	edited by Angelo Gavezzotti
シリーズ	The molecular solid state ; v. 1
データ種別	図書
出版情報	Chichester ; New York : J. Wiley , c1997
本文言語	英語
大きさ	x, 237 p. : ill. ; 24 cm
概要	The 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 i... 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. 続きを見る
目次	v. 1. Theoretical aspects and computer modeling of the molecular solid state / edited by Angelo Gavezzotti v. 2. Organised molecular assemblies in the solid state / edited by James K. Whitesell v. 3. Reactivity of molecular solids / edited by Elena Boldyreva and Vladimir Boldyrev

状態	巻次	所蔵場所	請求記号	刷年	文庫名称	資料番号	コメント	予約・取寄	複写申込	自動書庫
		芸工図 2F 書架	428.4/G27	1997		072032196010322		予約・取寄			予約・取寄

一般注記	Includes bibliographical references and index
著者標目	Gavezzotti, Angelo
件　名	LCSH:Molecular crystals
分　類	LCC:QD921 DC20:541.2/2
書誌ID	1001355352
ISBN	0471961876
NCID	BA29990418
巻冊次	ISBN:0471961876
登録日	2009.09.18
更新日	2009.09.18