Department Details

Interdisciplinary School of Scientific Computing

1)    Kashid, V., Shah, V., Salunke, H.G., Mokrousov, Y., Blügel, S. (2015). Magnetic properties of 2D nickel nanostrips: Structure dependent magnetism and Stoner criterion . Journal of Physics Condensed Matter, 27 (31), 316002. ISSN(print/online): 0953-8984 /1361-648X, URL/DOI: http://dx.doi.org/10.1088/0953-8984/27/31/316002
2)    Kashid, V., Schena, T., Zimmermann, B., Mokrousov, Y., Blügel, S., Shah, V., Salunke, H.G. (2014). Dzyaloshinskii-Moriya interaction and chiral magnetism in 3d-5d zigzag chains: Tight-binding model and ab initio calculations. Physical Review B, 90 (5), 054412. Google Scholar Citations: 12, WoS Citations: 24, ISSN(print/online): 2469-9950/2469-9969, URL/DOI: http://dx.doi.org/10.1103/PhysRevB.90.054412
3)    Kashid, V., Shah, V., Salunke, H. (2011). Electronic structure effects on stability and quantum conductance in 2D gold nanowires. Journal of Nanoparticle Research, 13 (10), 5225-5238. Google Scholar Citations: 7, WoS Citations: 6, ISSN(print/online): 1388-0764/1572-896X, URL/DOI: http://dx.doi.org/10.1007/s11051-011-0507-8
  

Publications Before 2011


4)    Shah, V., Kanhere, D.G. (2009). Electronic structure and magnetic properties of Ni 3 n Al n clusters. Physical Review B, 80 (12), 125419. Google Scholar Citations: 7, WoS Citations: 9, ISSN(print/online): 2469-9950/2469-9969 , URL/DOI: http://dx.doi.org/10.1103/PhysRevB.80.125419
5)    Dutt, P.K., Bedekar, S. (2001). Spectral methods for hyperbolic initial boundary value problems on parallel computers. Journal of Computational and Applied Mathematics, 134 (1-2), 162-190. Google Scholar Citations: 15, WoS Citations: 8, ISSN(print/online): 0377-0427, URL/DOI: http://dx.doi.org/10.1016/S0377-0427(00)00535-5
6)    Shah, V., Bowen, H.F., Space, B. (2000). A molecularly detailed description of metal-dielectric interfaces: The crossover from surface to bulk conducting properties of Ag-Xe. Journal of Chemical Physics, 112 (24), 10998-11004. Google Scholar Citations: 7, WoS Citations: 8, ISSN(print/online): 0021-9606/1089-7690, URL/DOI: http://dx.doi.org/10.1063/1.481739
7)    Shah, V. and Yang, L. (1999). Nanometre fcc clusters versus bulk bcc alloy: the structure of Cu-Pd catalysts. Philosophical Magazine A, 79 (8), 2025-2049. Google Scholar Citations: 20, WoS Citations: 14, ISSN(print/online): 0141-8610, URL/DOI: http://dx.doi.org/10.1080/01418619908210407
8)    Dhavale, A., Shah, V., Kanhere, D.G. (1998). Structure and stability of Al-doped small Na clusters: Na n Al (n= 1, 10). Physical Review A, 57 (6), 4522-4527. Google Scholar Citations: 31, WoS Citations: 28, ISSN(print/online): 2469-9926/2469-9934, URL/DOI: http://dx.doi.org/10.1103/PhysRevA.57.4522
9)    Nehete, D., Shah, V., 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), 2126-2131. Google Scholar Citations: 48, WoS Citations: 36, ISSN(print/online): 2469-9950/2469-9969, URL/DOI: http://dx.doi.org/10.1103/PhysRevB.53.2126
10)    Majumder, C., Das, G.P., Kulshrestha, S.K., Shah, V., Kanhere, D.G. (1996). Ground state geometries and energetics of AL(n)Li (n=1,13) clusters using ab initio density-based molecular dynamics. Chemical Physics Letters, 261 (4), 515-520. Google Scholar Citations: 36, WoS Citations: 35, ISSN(print/online): 0009-2614/1873-4448, URL/DOI: http://dx.doi.org/10.1016/0009-2614(96)01028-7
11)    Shah, V., Kanhere, D.G. (1996). Ground-state geometries and the stability of some clusters investigated using density-based ab initio molecular dynamics. Journal of Physics Condensed Matter, 8 (17), L253-L260. Google Scholar Citations: 23, WoS Citations: 17, ISSN(print/online): 0953-8984/1361-648X, URL/DOI: http://dx.doi.org/10.1088/0953-8984/8/17/001
12)    Shah, V., Nehete, D., Kanhere, D.G. (1994). Ab initio molecular dynamics via density based energy functionals. Journal of Physics Condensed Matter, 6, 10773-10781. Google Scholar Citations: 39, WoS Citations: 37, ISSN(print/online): 0953-8984/1361-648X, URL/DOI: http://dx.doi.org/10.1088/0953-8984/6/49/018