The Electronic Structure of Heavy Element Complexes
Description
The area of study is the bonding in heavy element complexes, and the application of more sophisticated electronic structure theories. Progress is recounted in several areas: (a) technological advances and current methodologies - Relativistic effects are extremely important in gaining an understanding of the electronic structure of compounds of the actinides, transactinides, and other heavy elements. Therefore, a major part of the continual benchmarking was the proper inclusion of the appropriate relativistic effects for the properties under study. (b) specific applications - These include organoactinide sandwich complexes, CO activation by actinide atoms, and theoretical studies of molecules of the transactinide elements. Finally, specific directions in proposed research are described
Availability note (English)
Available from as paper copy at OSTI: phone, 865-576-8401, or email, reports@adonis.osti.govAdditional details
Publishing Information
- Imprint Pagination
- 16 p.
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 34021985
- Subject category
- S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY; S74: ATOMIC AND MOLECULAR PHYSICS;
- Resource subtype / Literary indicator
- Non-conventional Literature
- Descriptors DEI
- ACTINIDE COMPLEXES; ACTINIDES; BONDING; CHEMICAL BONDS; ELECTRONIC STRUCTURE; RELATIVISTIC RANGE; TRANSURANIUM COMPLEXES
- Descriptors DEC
- COMPLEXES; ELEMENTS; ENERGY RANGE; FABRICATION; JOINING; METALS
Optional Information
- Contract/Grant/Project number
- FG02-86ER13529
- Funding organization
- USDOE Office of Energy Research (ER) (United States)