Items where Author is "Shah, Vaishali"

Shah, Vaishali ; Kanhere, D. G. (2009) Electronic structure and magnetic properties of Ni_3nAl_n clusters Physical Review B, 80 (12). pp. 125419_1-125419_8. ISSN 0163-1829

Shafai, Ghazal S. ; Shetty, Sharan ; Krishnamurty, Sailaja ; Shah, Vaishali ; Kanhere, D. G. (2007) Density functional investigation of the interaction of acetone with small gold clusters Journal of Chemical Physics, 126 (1). pp. 014704_1-014704_8. ISSN 1674-0068

Dhavale, Ajeeta ; Shah, Vaishali ; Kanhere, D. G. (1998) Structure and stability of Al-doped small Na clusters: Na_nAl (n=1,10) Physical Review A, 57 (6). pp. 4522-4527. ISSN 1050-2947

Shah, Vaishali ; Kanhere, D. G. ; Majumder, Chiranjib ; Das, G. P. (1997) An ab initio molecular dynamics investigation of Li_nAl_n clusters Journal of Physics: Condensed Matter, 9 (10). pp. 2165-2177. ISSN 0953-8984

Majumder, C. ; Das, G. P. ; Kulshrestha, S. K. ; Shah, Vaishali ; Kanhere, D. G. (1996) Ground state geometries and energetics of AL_nLi (n=1,13) clusters using ab initio density-based molecular dynamics Chemical Physics Letters, 261 (4-5). pp. 515-520. ISSN 0009-2614

Shah, Vaishali ; Kanhere, D. G. (1996) Ground-state geometries and the stability of some clusters Li_nAl_m investigated using density-based ab initio molecular dynamics Journal of Physics: Condensed Matter, 8 (17). pp. L253-L260. ISSN 0953-8984

Nehete, Dinesh ; Shah, Vaishali ; Kanhere, D. G. (1996) Ab initio molecular dynamics using density-based energy functionals: application to ground-state geometries of some small clusters Physical Review B, 53 (4). pp. 2126-2131. ISSN 0163-1829