Published April 1985
| Version v1
Journal article
Transition metal oxides - CrO, MoO, NiO, PdO, AgO
- 1. NASA, Ames Research Center, Moffett Field, CA
Description
The transition-metal oxides are quite ionic; Mulliken population analyses for several oxides give a negative charge of about 0.7 electrons for oxygen. When the transition-metal d shell is only partially filled, the orbitals are involved in covalent bonds with O; both two-electron bonding (2)-antibonding (0) and one-electron bonding (2)-antibonding (1) bonds are formed. These covalent bonds occur in addition to the ionic bonding. There is d-sigma-O2 p sigma repulsion, and this repulsion is reduced when the d-sigma electron is promoted into an orbital which has dominantly 4sp-sigma character and is polarized away from O. 27 references
Additional details
Publishing Information
- Journal Title
- J. Chem. Phys.
- Journal Volume
- 82
- Series
- J. Chem. Phys.
- Journal Page Range
- 3265-3276
- ISSN
- 0021-9606
- CODEN
- JCPSA
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 17014018
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- CHEMICAL BONDS; CHROMIUM OXIDES; ELECTRONIC STRUCTURE; MOLYBDENUM OXIDES; NICKEL OXIDES; PALLADIUM COMPOUNDS; SILVER OXIDES
- Descriptors DEC
- CHALCOGENIDES; CHROMIUM COMPOUNDS; MOLYBDENUM COMPOUNDS; NICKEL COMPOUNDS; OXIDES; OXYGEN COMPOUNDS; SILVER COMPOUNDS; TRANSITION ELEMENT COMPOUNDS