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Some aspects of the development of the methods of calculation of atomic structures
Author(s) -
Jucys Adolfas Pranaitis
Publication year - 2009
Publication title -
international journal of quantum chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.484
H-Index - 105
eISSN - 1097-461X
pISSN - 0020-7608
DOI - 10.1002/qua.560010604
Subject(s) - atomic orbital , wave function , atom (system on chip) , computational chemistry , function (biology) , linear combination of atomic orbitals , slater type orbital , atomic physics , physics , chemistry , quantum mechanics , computer science , electron , evolutionary biology , biology , embedded system
The method of constructing the wave function of the atom in ordinary methods of calculation and methods of determining the radial orbitals are considered. The improved methods of calculation are characterized.