63 citations · 297 across the 17 of their papers we have counts for
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Remarkable Hydrogen Storage on Beryllium Oxide Clusters: First Principles Calculations
Ravindra Shinde, Meenakshi Tayade
Since the current transportation sector is the largest consumer of oil, and subsequently responsible for major air pollutants, it is inevitable to use alternative renewable sources…
Ab initio Calculations of Optical Properties of Clusters
Ravindra Shinde
We have performed systematic large-scale all-electron correlated calculations on boron Bn, aluminum Aln and magnesium Mgn clusters (n=2--5), to study their linear optical absorptio…
First principles electron-correlated calculations of optical absorption in magnesium clusters
Ravindra Shinde, Alok Shukla
In this paper, we report large-scale configuration interaction (CI) calculations of linear optical absorption spectra of various isomers of magnesium clusters Mg (n=2--5), co…
Large-scale first principles configuration interaction calculations of optical absorption in aluminum clusters
Ravindra Shinde, Alok Shukla
We report the linear optical absorption spectra of aluminum clusters Al (n=2--5) involving valence transitions, computed using the large-scale all-electron configuration inte…
Optical Absorption in B Cluster: A Time-Dependent Density Functional Approach
Ravindra Shinde, Meenakshi Tayade
The linear optical absorption spectra of three isomers of planar boron cluster B are calculated using time-dependent spin-polarized density functional approach. The geometri…
Optical absorption in boron clusters B and B : A first principles configuration interaction approach
Ravindra Shinde, Alok Shukla
The linear optical absorption spectra in neutral boron cluster B and cationic B are calculated using a first principles correlated electron approach. The geometries…