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Quantum Crystallography: Expectations vs Reality
紀錄類型:
書目-語言資料,印刷品 : Monograph/item
正題名/作者:
Quantum Crystallography: Expectations vs Reality/ by Piero Macchi.
作者:
Macchi, Piero.
面頁冊數:
VI, 96 p. 29 illus., 20 illus. in color.online resource. :
Contained By:
Springer Nature eBook
標題:
Quantum Chemistry. -
電子資源:
https://doi.org/10.1007/978-3-030-95641-7
ISBN:
9783030956417
Quantum Crystallography: Expectations vs Reality
Macchi, Piero.
Quantum Crystallography: Expectations vs Reality
[electronic resource] /by Piero Macchi. - 1st ed. 2022. - VI, 96 p. 29 illus., 20 illus. in color.online resource. - SpringerBriefs in Crystallography,2524-860X. - SpringerBriefs in Crystallography,.
Chapter 1. Introduction -- Chapter 2. How does quantum mechanics jump in the field of crystallography? -- Chapter 3. Beyond the semi-classical view of atoms and molecules in crystals -- Chapter 4. Testing chemical bond theories with Quantum crystallography -- Chapter 5. Calculating the crystal wavefunction from crystallographic experiments -- Chapter 6. Crystallography and the standard model -- Chapter 7. Quantum Crystallography in the everyday life of a crystallographer and a quantum chemist -- Chapter 8. Concluding remarks.
This book explores the potential of quantum crystallography. The field accompanied the major milestones of x-ray diffraction and it has undergone a rapid evolution in the past few years. For this reason, some reflections are necessary in order to scrutinize the next steps and anticipate the future developments. After a short survey of the historical background and in depth description of the state of the art, some examples are provided of current and future applications of the know-how in this discipline. This implies attracting readership of both experts in the field and neophytes. The former will test their own views with the one exposed in the book; the newcomers, instead, will learn both what has been done and what could be done with quantum crystallography.
ISBN: 9783030956417
Standard No.: 10.1007/978-3-030-95641-7doiSubjects--Topical Terms:
1391145
Quantum Chemistry.
LC Class. No.: QD901-999
Dewey Class. No.: 548
Quantum Crystallography: Expectations vs Reality
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Chapter 1. Introduction -- Chapter 2. How does quantum mechanics jump in the field of crystallography? -- Chapter 3. Beyond the semi-classical view of atoms and molecules in crystals -- Chapter 4. Testing chemical bond theories with Quantum crystallography -- Chapter 5. Calculating the crystal wavefunction from crystallographic experiments -- Chapter 6. Crystallography and the standard model -- Chapter 7. Quantum Crystallography in the everyday life of a crystallographer and a quantum chemist -- Chapter 8. Concluding remarks.
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