| Autor: |
Hobbs, J. David, Cygan, Randall T. |
| Předmět: |
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| Zdroj: |
American Mineralogist; Jul/Aug97, Vol. 82 Issue 7/8, p657, 6p, 1 Diagram, 2 Charts, 4 Graphs |
| Abstrakt: |
Presents the results of a study which used a first-principle, quantum chemical code based on local density functional theory, to perform calculations that minimize the energy and optimize the geometry of atomic coordinates for kaolinite crystal structures. Performance of calculations using published unit-cell parameters. |
| Databáze: |
Complementary Index |
| Externí odkaz: |
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