НАНОСИСТЕМЫ: ФИЗИКА, ХИМИЯ, МАТЕМАТИКА, 2010, ТОМ 1, № 1, С. 63–71
НАНОТУБУЛЯРНЫЕ КОМПОЗИТЫ:
МОДЕЛИРОВАНИЕ КАПИЛЛЯРНОГО ЗАПОЛНЕНИЯ
НАНОТРУБОК ДИСУЛЬФИДА МОЛИБДЕНА
МОЛЕКУЛАМИ TiCl4
А. Н. Еняшин(1), А. Л. Ивановский(1)
(1)Институт химии твёрдого тела Уральского Отделения РАН, Екатеринбург
enyashin@ihim.uran.ru, ivanovskii@ihim.uran.ru
Представлены результаты молекулярно-динамического моделирования процесса капиллярного заполнения нанотрубок дисульфида молибдена MoS2 молекулами тетрахлорида титана TiCl4 с образованием нанотубулярного композита TiCl4TMoS2.
Ключевые слова: нанотубулярные композиты, капиллярное заполнение трубок, моделирование.
УДК 541.16
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