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Structure and Vibrational Spectra of a Model of a‐Si:H with Periodic Boundary Conditions
Author(s) -
Winer K.,
Wooten F.
Publication year - 1984
Publication title -
physica status solidi (b)
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.51
H-Index - 109
eISSN - 1521-3951
pISSN - 0370-1972
DOI - 10.1002/pssb.2221240204
Subject(s) - spectral line , boundary (topology) , materials science , molecular physics , physics , mathematics , mathematical analysis , quantum mechanics
A ball‐and‐stick model of a‐Si:H with periodic boundary conditions is constructed. A computer replica of the structure is relaxed and the density, radial distribution function, and vibrational spectracalculated.