Vibrational dynamics of solid poly(ethylene oxide)
نویسندگان
چکیده
منابع مشابه
Vibrational dynamics of solid poly ( ethylene oxide )
Molecular dynamics (MD) simulations of crystalline poly(ethylene oxide) (PEO) have been carried out in order to study its vibrational properties. The vibrational density of states has been calculated using a normal mode analysis (NMA) and also through the velocity autocorrelation function of the atoms. Results agree well with experimental spectroscopic data. System size effects in the crystalli...
متن کامل2 00 3 Vibrational dynamics of solid poly ( ethylene oxide )
Molecular dynamics (MD) simulations of crystalline poly(ethylene oxide) (PEO) have been carried out in order to study its vibrational properties. The vibrational density of states has been calculated using a normal mode analysis (NMA) and also through the velocity autocorrelation function of the atoms. Results agree well with experimental spectroscopic data. System size effects in the crystalli...
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ژورنال
عنوان ژورنال: Physical Review B
سال: 2003
ISSN: 0163-1829,1095-3795
DOI: 10.1103/physrevb.68.064304