Calculation of the Energy Band Structures of Complicated Periodic DNA Models in the Semiempirical SCF–LCAO–Crystal‐Orbital Approximation
作者： B. F. Rozsnyai , F. Martino , J. Ladik
DOI: 10.1063/1.1672849
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摘要: The electronic wavefunctions and energy bands of periodic DNA models consisting two superimposed base pairs as unit cells have been calculated in the semiempirical SCF–LCAO–crystal‐orbital approximation. results obtained for poly(A–T; G–C), C–G), T–A), poly(G–C; C–G) indicate that bandwidths, contrast to those previously poly(A–T) poly(G–C) cases, are quite narrow.
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