| Autor: |
Abdurahman, Ayjamal, Albrecht, Martin, Shukla, Alok, Dolg, Michael |
| Předmět: |
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| Zdroj: |
Journal of Chemical Physics; 5/1/1999, Vol. 110 Issue 17, p8819, 6p, 2 Diagrams, 5 Charts, 8 Graphs |
| Abstrakt: |
Discusses the results of Wannier orbital-based Hartree-Fock and various correlated ab initio calculations using basis sets for two boron-nitrogen polymer systems. Calculation of the equilibrium geometries, cohesive energies and polymerization energies at the Hartree-Fock level; Electron correlation effects on the investigated ground state properties. |
| Databáze: |
Complementary Index |
| Externí odkaz: |
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