Intrinsic structures and properties of energetic materials / Chaoyang Zhang, Jing Huang, Rupeng Bu.
Zhang, Chaoyang, author.; Huang, Jing, author.; Bu, Rupeng, author.
2023
TP270
Available Online

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Title Intrinsic structures and properties of energetic materials / Chaoyang Zhang, Jing Huang, Rupeng Bu.
Author Zhang, Chaoyang, author.
ISBN 9789819926992 (electronic bk.)
9819926998 (electronic bk.)
9789819926985
981992698X
DOI https://doi.org/10.1007/978-981-99-2699-2
Published Singapore : Springer, 2023.
Language English
Description 1 online resource (xviii, 458 pages) : illustrations (some color)
Item Number 10.1007/978-981-99-2699-2 doi
Call Number TP270
Dewey Decimal Classification 662.2
Summary This book highlights the intrinsic structures of all kinds of energetic compounds and some structure-property relationships therein. Energetic materials are a class of energy materials that can transiently release a large amount of gases and heat by self-redox after stimulated and usually refer to explosives, propellants and pyrotechnics. Nowadays, in combination with various theories and simulation-aided material design technologies, many new kinds of energetic materials like energetic extended solids, energetic ionic salts, energetic metal organic frames, energetic co-crystals and energetic perovskites have been created, in addition to traditional energetic molecular crystals. It is somewhat dazzling, and an issue of how we can understand these new types of energetic materials is raised. In the past about 20 years, we were immersed in the computational energetic materials. By means of defining a concept of intrinsic structures of energetic materials, which refers to the crystal packing structure of energetic materials, as well as molecule for molecular solid specially, the microscopic structures have been mostly clarified, and related with many macroscopic properties and performances, with molecular simulations. This book presents our understanding about it. Thereby, a simply and new way to readily understand energetic materials is expected to be paved, based on this book. It contains energetic molecular crystals, energetic ionic crystals, energetic atomic crystals, energetic metallic crystals and energetic mixed-type crystals and the substructures closest to crystal packing. Meanwhile, the common intermolecular interactions in energetic crystals will be introduced. In addition, theoretical and simulation methods for treating the intrinsic structures will be briefed, as they are the main tools to reveal the molecules and crystals. Besides, the polymorphism as a level of intrinsic structures will be briefly discussed. In the final of this book, we introduce the crystal engineering of energetic materials. This book features the first proposal of intrinsic structure and crystal engineering of energetic materials and the understanding of the properties and performances of energetic materials by maintaining a concept that structure determines property. It helps to promote the rationality in creating new energetic materials, rather than increase experience.
Bibliography, etc. Note Includes bibliographical references.
Access Note Access limited to authorized users.
Source of Description Online resource; title from PDF title page (SpringerLink, viewed July 7, 2023).
Added Author Huang, Jing, author.
Bu, Rupeng, author.
Available in Other Form Print version: 9789819926985
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Introduction
Classification of Energetic Crystals
Application of molecular simulation methods in treating intrinsic structures of energetic materials
Energetic molecules & single-component energetic molecular crystals
Polymorphism and polymorphic transition in energetic molecular crystals
Energetic ionic crystals
Energetic cocrstals
Energetic atomic crystals, energetic metallic crystals & energetic mixed-type crystals
Hydrogen bonding, hydrogen transfer and halogen bonding
[pi]-stacking in energetic crystals
Crystal engineering for creating low sensitive and highly energetic materials.

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