Published July 1977
| Version v1
Journal article
Study of possibilities of calculation of atomic structures by the method of model potential
- 1. Rostovskij-na-Donu Gosudarstvennyj Univ. (USSR)
Description
The possibility of calculation of energy position of individual levels of atomic structures by a model potential method has been shown. Values of ionization potentials of all the Ne levels and energy difference of 1P and 3P terms of 3p53d1Ca(3), Sc(4) configuration, which were calculated by the suggested method are in a good agreement with experimental values. It is shown, that additional accounting of a spherical part of ligand potential in an isolated ion model considerably improves calculation and experiment agreement of values of ionization potentials and Nsub(4,5) fine structure details -lanthanum absorption spectra
Additional details
Additional titles
- Original title (Russian)
- Исследование возможности расчета атомных структур методом модельного потенциала
Publishing Information
- Journal Title
- Zh. Strukt. Khim.
- Journal Volume
- 18
- Journal Issue
- 4
- Series
- Zh. Strukt. Khim.
- Journal Page Range
- 635-643
Conference
- Title
- Roentgenoelectronic and roentgen spectra and electronic structure of metals, alloys and chemical compounds.
- Dates
- 7 - 10 Sep 1976.
- Place
- Sverdlovsk, USSR.
INIS
- Country of Publication
- USSR
- Country of Input or Organization
- USSR
- INIS RN
- 10447818
- Subject category
- S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
- Resource subtype / Literary indicator
- Conference
- Descriptors DEI
- ATOMIC MODELS; CONFIGURATION INTERACTION; D STATES; ELECTRONIC STRUCTURE; IONIZATION POTENTIAL; P STATES; SCANDIUM COMPOUNDS
- Descriptors DEC
- ENERGY LEVELS; MATHEMATICAL MODELS; TRANSITION ELEMENT COMPOUNDS
Optional Information
- Notes
- For English translation see the journal J. Struct. Chem.