scholarly journals Энергетический спектр и спектр оптического поглощения эндоэдральных фуллеренов Lu-=SUB=-3-=/SUB=-N@C-=SUB=-80-=/SUB=- и Y-=SUB=-3-=/SUB=-N@C-=SUB=-80-=/SUB=- в модели Хаббарда

2022 ◽  
Vol 64 (2) ◽  
pp. 294
Author(s):  
А.В. Силантьев

Anticommutator Green’s functions and energy spectra of fullerene C80, endohedral fullerenes Lu3N@С80 and Y3N@С80 with the Ih symmetry groups have been obtained in an analytical form within the Hubbard model and static fluctuation approximation. The energy states have been classified using the methods of group theory, and the allowed transitions in the energy spectra of molecules C80, Lu3N@С80 and Y3N@С80have been determined. On the basis of these spectra, an interpretation of experimentally observed optical absorption bands endohedral fullerenes Lu3N@С80 and Y3N@С80.

2019 ◽  
Vol 61 (2) ◽  
pp. 395
Author(s):  
А.В. Силантьев

Abstract —Anticommutator Green’s functions and energy spectra of fullerene C_20 with the I _ h , D _5 d , and D _3 d symmetry groups have been obtained in an analytical form within the Hubbard model and static fluctuation approximation. The energy states have been classified using the methods of group theory, and the allowed transitions in the energy spectra of fullerene C_20 with the I _ h , D _5 d , and D _3 d symmetry groups have been determined. It is also shown how the energy levels of fullerene C_20 with the I _ h symmetry group are split with the symmetry reduction.


2020 ◽  
Vol 62 (3) ◽  
pp. 473
Author(s):  
А.В. Силантьев

Anticommutator Green’s functions and energy spectra of fullerene C24 with the D6, D6d, and Oh symmetry groups have been obtained in an analytical form within the Hubbard model and static fluctuation approximation. The energy states have been classified using the methods of group theory, and the allowed transitions in the energy spectra of fullerene C24 with the D6, D6d, and Oh symmetry groups have been determined.


2020 ◽  
Vol 62 (11) ◽  
pp. 1960
Author(s):  
А.В. Силантьев

Anticommutator Green’s functions and energy spectra of fullerene C28 and endofullerene Zr@C28 with the Td symmetry groups have been obtained in an analytical form within the Hubbard model and static fluctuation approxima-tion. The energy states have been classified using the methods of group theory, and the allowed transitions in the energy spectra of fullerene C28 and endofull-erene Zr@C28 with the Td symmetry groups have been determined.


2021 ◽  
Vol 63 (11) ◽  
pp. 1951
Author(s):  
А.В. Силантьев

Anticommutator Green’s functions and energy spectra of fullerene C26 and endohedral fullerene U@C26 with the D3h symmetry groups have been obtained in an analytical form within the Hubbard model and static fluctuation ap-proximation. The energy states have been classified using the methods of group theory, and the allowed transitions in the energy spectra of molecules C26 and U@C26 with the D3h symmetry groups have been determined.


2021 ◽  
Vol 129 (10) ◽  
pp. 1227
Author(s):  
А.В. Силантьев

The anticommutative Green’s functions were derived in an analytical form, and the energy spectra of С80 fullerene and endohedral Y3N@C80 fullerene of symmetry group Ih were obtained within the Hubbard model in the mean-field approximation. Using group theory methods, the classification of energy states was carried out, and the allowed transitions in the energy spectra of С80 and Y3N@C80 molecules of symmetry group Ih were determined.


2019 ◽  
Vol 127 (8) ◽  
pp. 191
Author(s):  
А.В. Силантьев

AbstractThe anticommutator Green’s functions and the energy spectra of fullerene С_36 and endohedral fullerene La@C_36, with both of them belonging to the D _6 h symmetry group, are obtained analytically within the Hubbard model in the mean-field approximation. Using group-theory methods, their energy states are classified and allowed transitions in the energy spectra of the С_36 and La@C_36 molecules, both belonging to the D _6 h symmetry group, are determined.


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