Items where Author is "Tanwar, Akhilesh"

Article

Gupta, Neelima ; Garg, Reena ; Shah, Kirti Kr. ; Tanwar, Akhilesh ; Pal, Sourav (2007) Deprotonation of 1,2-dialkylpyridinium ions: a DFT study of reactivity and site selectivity Journal of Physical Chemistry A, 111 (36). pp. 8823-8828. ISSN 1089-5639

Kulkarni, Bhakti S. ; Tanwar, Akhilesh ; Pal, Sourav (2007) Reactivity descriptors and electron density analysis for ligand chemistry: a case study of 2,2'-bipyridine and its analogues Journal of Chemical Sciences, 119 (5). pp. 489-499. ISSN 0253-4134

Tanwar, Akhilesh ; Bagchi, Biman ; Pal, Sourav (2006) Interaction induced shifts in O-H stretching frequency of water in halide-ion water clusters: a microscopic approach with a bond descriptor Journal of Chemical Physics, 125 (21). pp. 214304 _1-214304 _6. ISSN 0021-9606

Tanwar, Akhilesh ; Pal, Sourav ; Roy, Debesh Ranjan ; Chattaraj, Pratim Kumar (2006) Minimum magnetizability principle Journal of Chemical Physics, 125 (5). pp. 056101-056102. ISSN 1674-0068

Tanwar, Akhilesh ; Pal, Sourav (2005) Separability of local reactivity descriptors Journal of Chemical Sciences, 117 (5). pp. 497-505. ISSN 0253-4134

Tanwar, Akhilesh ; Pal, Sourav (2004) Behavior of the local reactivity descriptors during complexation: a case study of BXX'X' 'NH₃ (X, X', X" = H, F) Journal of Physical Chemistry A, 108 (52). pp. 11838-11845. ISSN 1089-5639