Polarization of the angular momentum of electrons in calculations of the electronic structure of the NiO 6 10? cluster by the x?-scattered-wave method

S. G. Gagarin; Yu. A. Teterin; Yu. V. Plekhanov

doi:10.1007/bf00945146

Polarization of the angular momentum of electrons in calculations of the electronic structure of the NiO 6 10? cluster by the x?-scattered-wave method

Theoretical and Experimental Chemistry ◽

10.1007/bf00945146 ◽

1986 ◽

Vol 21 (6) ◽

pp. 679-683

Author(s):

S. G. Gagarin ◽

Yu. A. Teterin ◽

Yu. V. Plekhanov

Keyword(s):

Electronic Structure ◽

Angular Momentum ◽

Scattered Wave ◽

Wave Method

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ChemInform Abstract: ELECTRONIC STRUCTURE CALCULATIONS FOR LARGE PLANAR MOLECULES BY SCF-SCATTERED WAVE METHOD

Chemischer Informationsdienst ◽

10.1002/chin.197407091 ◽

1974 ◽

Vol 5 (7) ◽

pp. no-no

Author(s):

D. A. LIBERMAN ◽

I. P. BATRA

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Electronic Structure Calculations ◽

Wave Method ◽

Planar Molecules ◽

Structure Calculations

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Application of the x? scattered-wave method for calculating the electronic structure of ccl4, sicl4, and gecl4, molecules

Theoretical and Experimental Chemistry ◽

10.1007/bf01004359 ◽

1978 ◽

Vol 14 (5) ◽

pp. 525-527

Author(s):

D. E. Onopko ◽

S. A. Titov

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method

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Electronic structure and related properties of ferrocyanide ion calculated by the SCF Xα-scattered wave method

Solid State Communications ◽

10.1016/0038-1098(76)90718-3 ◽

1976 ◽

Vol 19 (9) ◽

pp. viii

Author(s):

D. Guenzburger ◽

B. Maffeo ◽

M.L. de Siqueira

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method

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Ionization energies and electronic structure of N3P3Cl6 as determined by UV photoelectron spectroscopy and the Xα scattered wave method

Chemical Physics Letters ◽

10.1016/0009-2614(78)80288-7 ◽

1978 ◽

Vol 58 (2) ◽

pp. 252-258 ◽

Cited By ~ 4

Author(s):

L. Noodleman ◽

N.P.C. Westwood ◽

K.A.R. Mitchell

Keyword(s):

Electronic Structure ◽

Photoelectron Spectroscopy ◽

Scattered Wave ◽

Wave Method ◽

Ionization Energies ◽

Uv Photoelectron Spectroscopy

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Modeling of electronic structure of Co3O4 by X?-scattered wave method

Theoretical and Experimental Chemistry ◽

10.1007/bf00641333 ◽

1990 ◽

Vol 26 (3) ◽

pp. 271-279

Author(s):

S. G. Gagarin ◽

Yu. V. Plekhanov ◽

Yu. A. Teterin

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method

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Electronic structure and related properties of ferrocyanide ion calculated by the SCF Xα-scattered wave method

Journal of Physics and Chemistry of Solids ◽

10.1016/0022-3697(77)90142-1 ◽

1977 ◽

Vol 38 (1) ◽

pp. 35-39 ◽

Cited By ~ 12

Author(s):

D. Guenzburger ◽

B. Maffeo ◽

M.L. De Siqueira

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method

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Investigation of the electronic structure of point defects in ionic crystals by the cluster scattered wave method with the self-consistent calculation of the lattice distortion and long-range polarization

Radiation Effects and Defects in Solids ◽

10.1080/10420159508227182 ◽

1995 ◽

Vol 134 (1-4) ◽

pp. 51-55 ◽

Cited By ~ 1

Author(s):

A. B. Sobolev

Keyword(s):

Electronic Structure ◽

Long Range ◽

Point Defects ◽

Lattice Distortion ◽

Scattered Wave ◽

The Self ◽

Ionic Crystals ◽

Wave Method ◽

Consistent Calculation ◽

Self Consistent

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Calculation of the electronic structure of tetrahedral carbon, silicon, and germanium halides using the X? scattered-wave method

Theoretical and Experimental Chemistry ◽

10.1007/bf01128421 ◽

1980 ◽

Vol 15 (5) ◽

pp. 436-439

Author(s):

D. E. Onopko ◽

S. A. Titov

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method ◽

Silicon And Germanium

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Electronic structure of trans-[Cr(ox)2(py)2]- by the X.alpha.-scattered wave method

Inorganic Chemistry ◽

10.1021/ic00214a005 ◽

1985 ◽

Vol 24 (20) ◽

pp. 3100-3106 ◽

Cited By ~ 3

Author(s):

William D. Wheeler ◽

Ronald D. Poshusta

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method

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Calculation of the electronic structure of formaldehyde using overlapping spheres in the SCF Xα scattered-wave method

Chemical Physics Letters ◽

10.1016/0009-2614(74)80096-5 ◽

1974 ◽

Vol 28 (4) ◽

pp. 529-531 ◽

Cited By ~ 23

Author(s):

I.P. Batra ◽

O. Robaux

Keyword(s):

Electronic Structure ◽

Scattered Wave ◽

Wave Method ◽

Overlapping Spheres

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