The van der Waals potential energy surfaces and structures of He–ICl and Ne–ICl clusters
نویسندگان
چکیده
منابع مشابه
The van der Waals potential energy surfaces and structures of He–ICl and Ne–ICl clusters
The potential energy surfaces of the ground electronic state of rare gas interhalogen van der Waals molecules, Rg–ICl ~Rg5He, Ne!, are calculated at CCSD~T! ~coupled cluster using single and double excitations with a noniterative perturbation treatment of triple excitations! level of theory. Calculations have been performed with specific augmented correlation consistent basis sets for the noble...
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ژورنال
عنوان ژورنال: The Journal of Chemical Physics
سال: 2002
ISSN: 0021-9606,1089-7690
DOI: 10.1063/1.1506920