[Non-empirical interatomic potentials for transition metals]. Progress report
The report is divided into the following sections: potential-energy functions for d-band metals, potential-energy functions for aluminides and quasicrystals, electronic structure of complex structures and quasicrystals, potential-energy functions in transition-metal oxides, applications to defect structure and mechanical properties, and basic theory of interatomic potentials.
- Research Organization:
- Washington Univ., St. Louis, MO (United States). Dept. of Physics
- Sponsoring Organization:
- USDOE, Washington, DC (United States)
- DOE Contract Number:
- FG02-84ER45130
- OSTI ID:
- 10149038
- Report Number(s):
- DOE/ER/45130--8; ON: DE93013705
- Country of Publication:
- United States
- Language:
- English
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