Publications (27)
Dopant Induced Stabilization of Silicon Cluster at Finite Temperature
Shahab Zorriasatein, Kavita Joshi, D. G. Kanhere
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
Density functional investigations of defect induced mid-gap states in graphane
Bhalchandra S. Pujari, D. G. Kanhere
Finite Temperature Behavior of Small Silicon and Tin Clusters: An Ab Initio Molecular Dynamics Study
Sailaja Krishnamurty, Kavita Joshi, D. G. Kanhere +1
Thermodynamics of Na_8 and Na_{20} clusters studied with ab-initio electronic structure methods
Abhijat Vichare, D. G. Kanhere, S. A. Blundell
Structure, electronic properties and magnetic transition in manganese clusters
Mukul Kabir, Abhijit Mookerjee, D. G. Kanhere
Emergence of noncollinear magnetic ordering in small magnetic clusters: Mn$_n$ and As@Mn$_n$
Mukul Kabir, D. G. Kanhere, Abhijit Mookerjee
Size--sensitive melting characteristics of gallium clusters: Comparison of Experiment and Theory for Ga$_{17}{}^{+}$ and Ga$_{20}{}^{+}$
Sailaja Krishnamurty, S. Chacko, D. G. Kanhere +3
Metallic clusters on a model surface: quantum versus geometric effects
S. A. Blundell, Soumyajyoti Haldar, D. G. Kanhere
Evolution in the structural and bonding properties of Aluminum-Lithium clusters
S. Chacko, D. G. Kanhere, V. V. Paranjape
Ab initio density functional investigation of B_24 cluster: Rings, Tubes, Planes, and Cages
S. Chacko, D. G. Kanhere, I. Boustani
On the observed irregular melting temperatures of free sodium clusters
S. Chacko, D. G. Kanhere, S. A. Blundell
Ab initio molecular dynamics via density based energy functionals
Vaishali Shah, Dinesh Nehete, D. G. Kanhere
Large Magnetic Moments of Arsenic-Doped Mn Clusters and their Relevance to Mn-Doped III-V Semiconductor Ferromagnetism
Mukul Kabir, D. G. Kanhere, Abhijit Mookerjee
Why do gallium clusters have a higher melting point than the bulk?
S. Chacko, Kavita Joshi, D. G. Kanhere +1
Spin-Charge Separation in Two Dimensions - A Numerical Study
Mihir Arjunwadkar, P. V. Panat, D. G. Kanhere
Magic Melters' Have Geometrical Origin
Kavita Joshi, Sailaja Krishnamurty, D. G. Kanhere
Ab initio molecular dynamics using density based energy functionals: application to ground state geometries of some small clusters
Dinesh Nehete, Vaishali Shah, D. G. Kanhere
Effect of Vortex Screening on the Bose Glass to Entangled Liquid Transition of Flux Lines in Superconductors
Ajay Nandgaonkar, D. G. Kanhere, Nandini Trivedi
From graphene to graphane : A density functional investigation of metal insulator transition
Prachi Chandrachud, Bhalchandra S. Pujari, D. G. Kanhere
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
Geometric, electronic properties and the thermodynamics of pure and Al--doped Li clusters
Mal--Soon Lee, S. Gowtham, Haiying He +3
Finite temperature behavior of impurity doped Lithium cluster {\em viz} Li$_6$Sn
Kavita Joshi, D. G. Kanhere
The electronic structures, the equilibrium geometries and finite temperature properties of Na_n (n=39-55)
Shahab Zorriasatein, Mal-Soon Lee, D. G. Kanhere
Glassy clusters: Relations between their dynamics and characteristic features of their energy landscape
Sandip De, Bastian Schaefer, Ali Sadeghi +3
Thermodynamics of tin clusters
Kavita Joshi, D. G. Kanhere, S. A. Blundell
Correlation Induced Vanishing of the Gap Function on the Fermi Surface in High $T_c$ Superconductors
G. Baskaran, D. G. Kanhere, Mihir Arjunwadkar +1