KREMNIY SI(100)2×1 SIRTIDA ADSORBSIYALANGAN C20@CN VA C60@CN (N=1, 3) EKZOFULLERENLARINI FULLERENLAR ADSORBSIYASI MAVJUD BO’LMAGANDA VAQT PARAMETRLARI BO’YICHA BAHOLASH
DOI:
https://doi.org/10.65164/d6m70n48Ключевые слова:
fulleren, kremniy, adsorbsiya, aylanma harakat, presetsiya, chastota, temperatura, energiya, bog’, modellashtirish.Аннотация
Ushbu tadqiqot ishida Si(100)2×1 sirtining dimer qatorida Cn (n=1, 3) uglerod
klasterlari orqali adsorbsiyalangan C20@Cn va C60@Cn ekzofullerenlarining fullerenlar adsorbsiyasi
mavjud bo’lmaganda C20 va C60 fulleren molekulalarining Cn uglerod klasterlarini fulleren
molekulasiga ekzodrillovchi yakkalik C-C bog’ bo’ylab o’tuchi o’q atrofidagi aylanma va tebranma
(presetsion) harakat chastotalarini past temperaturalar sohasida (???? < 100 K) temperaturaga
bog’lanishi molekulyar dinamika usuli asosida ochiq manba simuliyatori LAMMPS paket dasturida
modellashtirilgan holda o’rganildi.
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