Non-empirical interatomic potentials for transition metals. (Progress report)
Technical Report
·
OSTI ID:5516092
Research is reported in the study of metallic bonding and interatomic potential functions. Topics covered include many-atom interactions and the notion of an effective pair potential in a metal, interactions between transition metal ions in semiconductors and insulators, mathematical techniques for extrapolation from incomplete information about atomic distribution functions, and bonding and electronic structure of filled d-band tetrahedral compounds. (GHT)
- Research Organization:
- Washington Univ., St. Louis, MO (USA)
- DOE Contract Number:
- FG02-84ER45130
- OSTI ID:
- 5516092
- Report Number(s):
- DOE/ER/45130-T1; ON: DE85013448
- Country of Publication:
- United States
- Language:
- English
Similar Records
[Non-empirical interatomic potentials for transition metals]. Progress report
[Non-empirical interatomic potentials for transition metals]
(Non-empirical interatomic potentials for transition metals, alloys, and semiconductors)
Technical Report
·
Sat May 01 00:00:00 EDT 1993
·
OSTI ID:10149038
[Non-empirical interatomic potentials for transition metals]
Technical Report
·
Thu Dec 31 23:00:00 EST 1992
·
OSTI ID:6570400
(Non-empirical interatomic potentials for transition metals, alloys, and semiconductors)
Technical Report
·
Sun Dec 31 23:00:00 EST 1989
·
OSTI ID:6521472
Related Subjects
36 MATERIALS SCIENCE
360102 -- Metals & Alloys-- Structure & Phase Studies
640305* -- Atomic
Molecular & Chemical Physics-- Atomic & Molecular Theory-- (-1987)
74 ATOMIC AND MOLECULAR PHYSICS
CHEMICAL BONDS
DISTRIBUTION FUNCTIONS
ELECTRONIC STRUCTURE
ELEMENTS
FUNCTIONS
INTERATOMIC FORCES
MATHEMATICAL MODELS
METALS
360102 -- Metals & Alloys-- Structure & Phase Studies
640305* -- Atomic
Molecular & Chemical Physics-- Atomic & Molecular Theory-- (-1987)
74 ATOMIC AND MOLECULAR PHYSICS
CHEMICAL BONDS
DISTRIBUTION FUNCTIONS
ELECTRONIC STRUCTURE
ELEMENTS
FUNCTIONS
INTERATOMIC FORCES
MATHEMATICAL MODELS
METALS