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- W2000239710 abstract "The valence electronic states of ortho-hydrogen crystals in h.c.p. lattice are calculated assuming space group Pca21 for the orientation of the molecules. The maximum and the minimum of the valence bands, whose width is found to be 0.080 Ryd, occur at the points X and Γ of the Brillouin zone. A detailed comparison with the energy bands of solid ortho-hydrogen in f.c.c. lattice is considered. The modifications of the energy levels in the case of a h.c.p. disordered structure arc also discussed. Les états électroniques de valence de l'ortho-hydrogène solide dans la phase h.c.p. ont étés calculés prenant le groupe spacial Pca21 pour les orientations des molecules. Le maximum et le minimum des bandes de valence, dont la largeur est de 0,080 Rydberg, se trouvent dans les points X et Γ de la zone de Brillouin respectivement. Une comparison détaillée avec les bandes d'énergie de l'ortho-hydrogène solide dans la phase f.c.c. a été considérée. Les modifications des niveaux d'énergie dans le cas d'une structure h.c.p. désordonnée sont aussi discutées." @default.
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- W2000239710 date "1973-12-01" @default.
- W2000239710 modified "2023-09-27" @default.
- W2000239710 title "Valence Bands of Solid Hydrogen in H.C.P. Lattice" @default.
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- W2000239710 doi "https://doi.org/10.1002/pssb.2220600237" @default.
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