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Classical Hamiltonians in molecular simulation
| Metadata Label | Value |
|---|---|
| Author(s): | Geerke, David Pieter |
| Publisher: | ETH |
| Citation: | Geerke, David Pieter. Classical Hamiltonians in molecular simulation. force-field development and explicit inclusion of electronic polarization and quantum effects by David Pieter Geerke. ETH (2007). http://dx.doi.org/10.3929/ethz-a-005486913 |
| Document Type: | Doctoral and Habilitation Theses |
| Documents: |
Abstract
(266.75KB) |
Detailed Information
| Metadata | Description |
|---|---|
| Title | Classical Hamiltonians in molecular simulation |
| Subtitle | force-field development and explicit inclusion of electronic polarization and quantum effects by David Pieter Geerke |
| Author(s) | Geerke, David Pieter |
| Publication Place | Zürich |
| Publisher | ETH |
| Publication Date | 2007 |
| Notes | Diss., Eidgenössische Technische Hochschule ETH Zürich, Nr. 17348, 2007 |
| Varying Title | Classical Hamiltonians in molecular simulation |
| Language | English |
| DOI | http://dx.doi.org/10.3929/ethz-a-005486913 |
| Subject(s) | Theoretical Chemistry, Quantum Chemistry |
| Keyword(s) |
MOLECULAR DYNAMICS MOLECULAR PHYSICS HAMILTON OPERATOR QUANTUM THEORY ELECTRON POLARIZATION PARTICLE PHYSICS ELECTRON STATES ELECTRONIC STRUCTURE CONDENSED MATTER PHYSICS INTERACTIONS OF ATOMS WITH OTHER ATOMS ATOMIC PHYSICS SOLVENT EFFECTS SOLVOLYSIS PHYSICAL CHEMISTRY |
| Description | File Name | MIME Type | Size |
|---|---|---|---|
| Abstract |
eth-29952-01.pdf |
application/pdf | 266.75KB |
| Description | URL |
|---|---|
| NEBIS Link | http://opac.nebis.ch/F/?local_base=NEBIS&func=find-b&find_code=SYS&request=005486913 |
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E-Collection record created: Sat, 19 Apr 2008, 05:30:12 CET