Animated molecular dynamics simulations of hydrated caesium-smectite interlayers
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چکیده
منابع مشابه
Animated molecular dynamics simulations of hydrated caesium-smectite interlayers
Computer animation of center of mass coordinates obtained from 800 ps molecular dynamics simulations of Cs-smectite hydrates (1/3 and 2/3 water monolayers) provided information concerning the structure and dynamics of the interlayer region that could not be obtained through traditional simulation analysis methods. Cs formed inner sphere complexes with the mineral surface, and could be seen to j...
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ژورنال
عنوان ژورنال: Geochemical Transactions
سال: 2002
ISSN: 1467-4866
DOI: 10.1186/1467-4866-3-73