Published September 1986
| Version v1
Journal article
Calculations of the electronic structure and interatomic interactions in vanadium and niobium hydrides, hydride carbides, and hydride nitrides by the cluster MO method
- 1. Institute of Chemistry, Urals Scientific Center
Description
The authors use a cluster approach to carry out systematic calculations of the electronic structure and the parameters of the chemical bonds in hexagonal hydride carbides and hydride nitrides of V and Nb, as well as in the original binary compounds. All the calculations were carried out by the extended Huckel method in all-valence-electron basis of Slater functions. The results of the calculations are presented
Additional details
Publishing Information
- Journal Title
- Inorg. Mater. (Engl. Transl.)
- Journal Volume
- 22
- Journal Issue
- 4
- Series
- Inorg. Mater. (Engl. Transl.).
- Journal Page Range
- 534-539
- ISSN
- 0020-1685
- CODEN
- INOMA
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 18040504
- Subject category
- S36: MATERIALS SCIENCE;
- Descriptors DEI
- BINDING ENERGY; CRYSTAL MODELS; ELECTRONIC STRUCTURE; ELECTRONS; HEXAGONAL LATTICES; HYDROGEN; NIOBIUM CARBIDES; NIOBIUM HYDRIDES; NIOBIUM NITRIDES; SLATER METHOD; STORAGE; VALENCE; VANADIUM CARBIDES; VANADIUM HYDRIDES; VANADIUM NITRIDES; X-RAY EMISSION ANALYSIS
- Descriptors DEC
- CARBIDES; CARBON COMPOUNDS; CHEMICAL ANALYSIS; CRYSTAL LATTICES; CRYSTAL STRUCTURE; ELEMENTARY PARTICLES; ELEMENTS; ENERGY; FERMIONS; HYDRIDES; HYDROGEN COMPOUNDS; LEPTONS; MATHEMATICAL MODELS; NIOBIUM COMPOUNDS; NITRIDES; NITROGEN COMPOUNDS; NONDESTRUCTIVE ANALYSIS; NONMETALS; TRANSITION ELEMENT COMPOUNDS; VANADIUM COMPOUNDS
Optional Information
- Notes
- Cover-to-cover translation of Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy (USSR).