Prediction of double chemical compounds with A15-type crystalline structure using electronic computer
Description
Double chemical compounds with a crystalline structure of the A15 type have been prognosticated with the aid of computer. The prognosis has been obtained from the data on the electronic structure of atoms in the normal state, with use being made of 85 examples of which 32 are examples of the presence and 53 are those of the absence of compounds of the A15 type. Results are given of prognosticating double compounds with a crystal lattice of the A15 type, based on the thorium and transuranium elements. The verification of a small amount of control data has shown a good fit to the prognosis. Ideal component ratio in the compounds corresponds to the stoichiometric formula A3B. Rare-earth elements, substituting from component B, must form compounds of the A15 type with d-elements of the 6 period. Lanthanides must form a structure of the A15 type with similar elements of the 4 period. The prognosis indicates that elements with a filled d-shell must be an indispensable component of phases of the A15 type
Additional details
Additional titles
- Original title (Russian)
- Прогноз двойных химических соединений с кристаллической структурой типа A15 при помощи EhVM
Publishing Information
- Journal Title
- Dokl. Akad. Nauk SSSR
- Journal Volume
- 223
- Journal Issue
- 6
- Series
- Dokl. Akad. Nauk SSSR.
- Journal Page Range
- 1383-1386
INIS
- Country of Publication
- USSR
- Country of Input or Organization
- USSR
- INIS RN
- 8305619
- Subject category
- S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY; S99: GENERAL AND MISCELLANEOUS;
- Descriptors DEI
- CHEMICAL COMPOSITION; COMPARATIVE EVALUATIONS; COMPUTER CALCULATIONS; CRYSTAL LATTICES; ELECTRONIC STRUCTURE; RARE EARTH COMPOUNDS; THORIUM COMPOUNDS; TRANSURANIUM COMPOUNDS
- Descriptors DEC
- ACTINIDE COMPOUNDS; CRYSTAL STRUCTURE