110 citations · 245 across the 13 of their papers we have counts for
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cond-mat.mtrl-sci2006
First principle investigation of the structural and electronic properties of the gallium clusters and their influence on the melting characteristics
Sailaja Krishnamurty, Kavita Joshi, Shahab Zorriasatein +1
First principle calculations have been performed to understand the experimentally observed size sensitive variations in the characteristics of heat capacities of gallium clusters […
cond-mat.mtrl-sci2006
A Comparative Study of Structural, Acidic and Hydrophobic properties of Sn-BEA with Ti--BEA using Periodic Density Functional Theory
Sharan Shetty, D. G. Kanhere, Sourav Pal +1
Periodic density functional theory has been employed to characterize the differences in the structural, Lewis acidic and hydrophobic properties of Sn--BEA and Ti--BEA. We show that…