Title of article :
Energetics and stability of small SimCn clusters: AM1 and PM3 calculations
Author/Authors :
?akir Erkoç، نويسنده , , Lemi Turker، نويسنده ,
Issue Information :
دوهفته نامه با شماره پیاپی سال 2000
Abstract :
The energetics and the structural stabilities of small SimCn clusters with m+n=2–5 have been investigated by AM1 and PM3 type semi-empirical molecular orbital methods within the RHF formalizm. It has been found that small silicon-carbide clusters prefer the linear structure.
Keywords :
AM1 method , Silicon-carbide clusters , PM3 method
Journal title :
Physica E Low-dimensional Systems and Nanostructures
Journal title :
Physica E Low-dimensional Systems and Nanostructures
