Torrent details for "Guo G. Electronic Structure Crystallography..Functional Motifs o…" Log in to bookmark
Controls:
×
Report Torrent
Please select a reason for reporting this torrent:
Your report will be reviewed by our moderation team.
×
Report Information
Loading report information...
This torrent has been reported 0 times.
Report Summary:
| User | Reason | Date |
|---|
Failed to load report information.
×
Success
Your report has been submitted successfully.
Checked by:
Category:
Language:
None
Total Size:
2.9 MB
Info Hash:
5D9452F55BABFE55B7FE44ED93AC583C1C86E016
Added By:
Added:
April 22, 2026, 10:45 p.m.
Stats:
|
(Last updated: April 22, 2026, 10:46 p.m.)
| File | Size |
|---|---|
| Guo G. Electronic Structure Crystallography..Functional Motifs of Materials 2024.pdf | 2.9 MB |
Name
DL
Uploader
Size
S/L
Added
-
383.2 MB
[33
/
13]
2024-06-09
| Uploaded by XXXClub | Size 383.2 MB | Health [ 33 /13 ] | Added 2024-06-09 |
NOTE
SOURCE: Guo G. Electronic Structure Crystallography..Functional Motifs of Materials 2024
-----------------------------------------------------------------------------------
COVER
-----------------------------------------------------------------------------------
MEDIAINFO
Textbook in PDF format Electronic Structure Crystallography and Functional Motifs of Materials Detailed resource on the method of electronic structure crystallography for revealing the experimental electronic structure and structure-property relationships of functional materials. Electronic Structure Crystallography and Functional Motifs of Materials describes electronic structure crystallography and functional motifs of materials, two of the most challenging topics to realize the rational design of high-performance functional materials, emphasizing the physical properties and structure-property relationships of functional materials using nonlinear optical materials as examples. The text clearly illustrates how to extract experimental electronic structure information and relevant physicochemical properties of materials based on the theories and methods in X-ray crystallography and quantum chemistry. Practical skills of charge density studies using experimental X-ray sources are also covered, which are particularly important for the future popularization and development of electron structure crystallography. This book also introduces the related theories and refinement techniques involved in using scattering methods (mainly X-ray single-crystal diffraction, as well as polarized neutron scattering and Compton scattering) to determine experimental electronic structures, including the experimental electron density, experimental electron wavefunction, and experimental electron density matrix of crystalline materials. Electronic Structure Crystallography and Functional Motifs of Materials includes information on: Basic framework and assumptions of the first-principle calculations, density matrix and density function, and Hartree-Fock (HF) and Kohn-Sham (KS) methods. Analysis of topological atoms in molecules, chemical interaction analysis, coarse graining and energy partition of the density matrix, and restricted space partition. Principles of electronic structure measurement, including thermal vibration analysis, scattering experiments, and refinement algorithm for experimental electronic structure. Independent atom model, multipole model, X-ray constrained wavefunction model, and other electron density models. Electronic Structure Crystallography and Functional Motifs of Materials is an ideal textbook or reference book for graduate students and researchers in chemistry, physics, and material sciences for studying the structures and properties of functional crystalline materials. Overview of Electronic Structure Crystallography First-Principles Calculations of the Electron Density Functions Topological Indices and Properties of Electronic Structures Principles of Electronic Structure Measurement Pseudo-atom Models Density Matrix Model Electron Wavefunction Models Functional Electronic Structures and Functional Motif of Materials
×