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VOLUME 29 (1979) | ISSUE 4 | PAGE 215
Variation of the electronic structure of Sb with pressure in the pseudopotential method
The electronic structure of Sb and its variation as a result of different lattice deformations were calculated on the computer. An improvement of the accuracy of calculation of the energies of the terms up to —10 ~5 hartree and of the cross-sectional areas of the isoenergetic surfaces up to ~ 1 % produced essentially a good agreement between the calculated variation with pressure of the electronic structure of Sb and the experiment. The main results of the calculations, their comparison with the experiment, and discussion are present.