Structural and Electronic Properties of (Al2O3)n Clusters with n=1–10 from First Principles Calculations AB Rahane, MD Deshpande, V Kumar The Journal of Physical Chemistry C 115 (37), 18111-18121, 2011 | 92 | 2011 |
B84: A quasi-planar boron cluster stabilized with hexagonal holes AB Rahane, V Kumar Nanoscale 7, 4055-4062, 2015 | 49 | 2015 |
Density Functional Calculations of the Structural and Electronic Properties of (Y2O3) n 0,±1 Clusters with n= 1–10 AB Rahane, PA Murkute, MD Deshpande, V Kumar The Journal of Physical Chemistry A 117 (26), 5542-5550, 2013 | 29 | 2013 |
Electronic Origin of the Stability of Transition Metal Doped B14 Drum Shaped Boron Clusters and Their Assembly in to a Nanotube P Saha, AB Rahane, V Kumar, N Sukumar The Journal of Physical Chemistry C, 2017 | 25 | 2017 |
Structural and Electronic Properties of Neutral and Ionic (Ga2O3)n Clusters with n= 1–10 AB Rahane, MD Deshpande The Journal of Physical Chemistry C 116 (4), 2691-2701, 2012 | 20 | 2012 |
Analysis of the electron density features of small boron clusters and the effects of doping with C, P, Al, Si, and Zn: Magic B7P and B8Si clusters P Saha, AB Rahane, V Kumar, N Sukumar Physica Scripta 91 (5), 053005, 2016 | 16 | 2016 |
Lithium storage in amorphous TiNi hydride: Electrode for rechargeable lithium-ion batteries M Bououdina, Y Oumellal, L Dupont, L Aymard, H Al-Gharni, A Al-Hajry, ... Materials Chemistry and Physics 141 (1), 348-354, 2013 | 16 | 2013 |
First Principles Calculations for Structural, Electronic, and Magnetic Properties of Gadolinium-Doped Alumina Clusters AB Rahane, MD Deshpande, V Kumar The Journal of Physical Chemistry C 116 (10), 6115-6126, 2012 | 15 | 2012 |
Optical Properties of Gallium Oxide Clusters from First-Principles Calculations AB Rahane, MD Deshpande, S Chakraborty The Journal of Physical Chemistry A 116 (43), 10559-10565, 2012 | 11 | 2012 |
Carbon Doping in Boron Suboxide : Structure, Energetics, and Elastic Properties AB Rahane, V Kumar, JS Dunn Journal of the American Ceramic Society, 2015 | 5 | 2015 |
Smallest Fullerene-like Structures of Boron with Cr, Mo, and W Encapsulation AB Rahane, P Saha, N Sukumar, K Vijay https://arxiv.org/abs/1907.12611, 2019 | 3 | 2019 |
Theoretical study of small clusters of manganese-doped gallium oxide: Mn(GaO)n and Mn2(GaO)n with n= 1− 7 A Rahane, M Deshpande, R Pandey Journal of Nanoparticle Research 12 (3), 727-736, 2010 | 3 | 2010 |
What does Electron Density Analysis tell us about Bonding in Transition Metal-doped Boron and Carbon Clusters? N Sukumar, P Saha, AB Rahane, R Agarwal, V Kumar Conference: Sagamore XIX Conference on Quantum Crystallography, 2018 | 1 | 2018 |
Time dependent DFT investigation of the optical response in pristine and Gd doped Al 2 O 3 S Kumavat, S Chakraborty, AB Rahane, MD Deshpande, R Ahuja RSC Advances 6 (76), 72537-72543, 2016 | 1 | 2016 |
First Principles Calculations Of Dopant Effects In Boron Suboxide JS Dunn, AB Rahane, V Kumar Developments in Strategic Ceramic Materials: A Collection of Papers …, 2015 | | 2015 |
Effect of Carbon Doping on the Electronic Structure and Elastic Properties of Boron Suboxide AB Rahane, JS Dunn, V Kumar ARMY RESEARCH LAB ABERDEEN PROVING GROUND MD WEAPONS AND MATERIALS RESEARCH …, 2015 | | 2015 |
First Principles Atomistic Model for Carbon-Doped Boron Suboxide AB Rahane, JS Dunn, V Kumar ARMY RESEARCH LAB ABERDEEN PROVING GROUND MD WEAPONS AND MATERIALS RESEARCH …, 2014 | | 2014 |
Theoretical Study of Structural, Magnetic and Optical Properties of Metal Oxide Nanostructures. AB Rahane Department of Physics, University of Pune, Pune, 2013 | | 2013 |