Theoretical alchemy: modeling matter
Saved in:
| Main Author: | |
|---|---|
| Format: | Book |
| Language: | English |
| Published: |
New Jersey [u.a.]
World Scientific Publ.
2010
|
| Online Access: | Inhaltsverzeichnis |
| Physical Description: | XIII, 196 S. graph. Darst. |
| ISBN: | 9789814322140 9814322148 9789814322133 |
Staff View
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Record in the Search Index
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|---|---|
| adam_text | Titel: Theoretical alchemy
Autor: Harrison, Walter A
Jahr: 2010
XI
Contents
Author s Note vii
1 Atomic States 1
1.1 Atomic Energy Levels 2
1.2 Atomic Levels as a Basis for Other Systems 4
1.3 Electron Density Distributions 6
1.4 The Basis of Pseudopotentials 8
1.5 Electron-Electron Interactions 10
1.6 Nuclear Structure 12
2 Hydrides 16
2.1 Hydrogen Molecules ^
2.2 Central Hydrides 19
2.3 Cohesion in the Central Hydrides 23
2.4 Ice and the Hydrogen Bond 23
2.5 Liquids and Solutions 25
2.6 Water near Metal Surfaces 29
3 Molecules 33
3.1 Molecular Orbitals
3.2 Lithium Molecule 35
3.3 Homopolar Molecules, Coupling 36
3.4 Polar Molecules, Hybrids ^l
3.5 Electron-Electron Interactions 46
xii Contents
3.6 Hydrocarbons 47
3.7 Revisiting Hydrides 49
4 Simple Metals 53
4.1 A Linear Chain 53
4.2 Three-Dimensional Lattices 56
4.3 Cohesion in Simple Metals 60
4.4 Other Properties 62
4.5 Surface States and H20 on a Metal Surface 64
5 Covalent Solids 68
5.1 Homopolar Semiconductors 69
5.2 Compound Semiconductors 71
5.3 Energy Bands 73
5.4 Other Nonmetallic Elements 77
5.5 Resonant Bonds 78
5.6 Covalent Insulators 82
6 Ionic Compounds 86
6.1 Cohesive Energies 87
6.2 Other Properties 90
6.3 Color Centers and Molecular Ions 94
6.4 Dioxides 96
6.5 Oxyanions and Solutions 100
7 Transition and/-Shell Metals 104
7.1 Transition Metals 104
7.2 The Friedel Model and Cohesion 110
7.3 Rare-Earth Metals 115
7.4 Actinides 119
8 Transition-Metal Compounds 122
8.1 Electronic Structure 122
8.2 AB Compounds with Bands 125
8.3 Localized States 127
8.4 Perovskites with Bands 130
8.5 Manganites and Cluster Orbitals 132
8.6 Conducting Manganites 134
8.7 Oxygen at Surfaces 137
Contents xiii
Appendixes 143
1A The van-der-Waals Interaction and Atomic Polarizability 143
2 A Calculation of Proton Positions 146
2B Radial Extension of s, p, and d States 151
2C The Nature of the Hydrogen Bond 152
3A Molecular Orbitals with Nonorthogonality 155
3B Homopolar Molecular Orbitals 158
3C Exchange 161
3D Polar Molecules 162
3D1 Cyanide, Füll Calculation 162
3D2 CN with Hybrids 163
3D3 Oxygen Metallization 164
3D4 Metallization of CN 166
4A Lithium Energy Bands 167
4B Metallic Crystal Structures 170
4C Water Molecules Bonding to Metals 171
5A Bonding in Si02 174
5B States in the Sulphate Ion 175
6A Dioxides 177
6A1 Sulphur Dioxide 177
6A2 Carbon Dioxide 180
6B Dioxides with Hybrids 181
8A The Special-Points Method 184
References 187
Subject Index 191
|
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| illustrated | Illustrated |
| indexdate | 2024-07-09T22:54:30Z |
| institution | BVB |
| isbn | 9789814322140 9814322148 9789814322133 |
| language | English |
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| physical | XIII, 196 S. graph. Darst. |
| publishDate | 2010 |
| publishDateSearch | 2010 |
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| publisher | World Scientific Publ. |
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| spelling | Harrison, Walter A. 1930- Verfasser (DE-588)138284261 aut Theoretical alchemy modeling matter Walter Harrison New Jersey [u.a.] World Scientific Publ. 2010 XIII, 196 S. graph. Darst. txt rdacontent n rdamedia nc rdacarrier HBZ Datenaustausch application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=021165927&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Harrison, Walter A. 1930- Theoretical alchemy modeling matter |
| title | Theoretical alchemy modeling matter |
| title_auth | Theoretical alchemy modeling matter |
| title_exact_search | Theoretical alchemy modeling matter |
| title_full | Theoretical alchemy modeling matter Walter Harrison |
| title_fullStr | Theoretical alchemy modeling matter Walter Harrison |
| title_full_unstemmed | Theoretical alchemy modeling matter Walter Harrison |
| title_short | Theoretical alchemy |
| title_sort | theoretical alchemy modeling matter |
| title_sub | modeling matter |
| url | http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=021165927&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA |
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