From Two- to Three-Dimensional Structures of a Supertetrahedral Boran Using Density Functional Calculations
نویسندگان
چکیده
منابع مشابه
From Two‐ to Three‐Dimensional Structures of a Supertetrahedral Boran Using Density Functional Calculations
With help of the DFT calculations and imposing of periodic boundary conditions the geometrical and electronic structures were investigated of two- and three-dimensional boron systems designed on the basis of graphane and diamond lattices in which carbons were replaced with boron tetrahedrons. The consequent studies of two- and three-layer systems resulted in the construction of a three-dimensio...
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ژورنال
عنوان ژورنال: Angewandte Chemie International Edition
سال: 2017
ISSN: 1433-7851
DOI: 10.1002/anie.201701225