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Issue DateTitleAuthor(s)
2013Optical absorption in boron clusters B-6 and B-6(+): a first principles configuration interaction singles approachSHINDE, R; SHUKLA, A
2011Quantification of binding affinities of essential sugars with a tryptophan analogue and the ubiquitous role of C-H center dot center dot center dot pi interactionsKUMARI, M; BALAJI, PV; SUNOJ, RB
2012Role of Explicit Solvents in Palladium(II)-Catalyzed Alkoxylation of Arenes: An Interesting Paradigm for Preferred Outer-Sphere Reductive Elimination over Inner-Sphere PathwayANAND, M; SUNOJ, RB
2012Selective recognition of fluoride and acetate by a newly designed ruthenium framework: experimental and theoretical investigationsKUNDU, T; CHOWDHURY, AD; DE, D; MOBIN, SM; PURANIK, VG; DATTA, A; LAHIRI, GK
2012Structural characterization of III-V zinc blende compound semiconductors using Monte Carlo simulationsRATHI, P; SIKDER, S; ADHIKARI, J
2012Theoretical Investigation of Magnetic and Conducting Properties of Substituted Silicon Chains. I. Hydrogen and Oxo-Verdazyl LigandsHANSDA, S; LATIF, IA; DATTA, SN
2013Theoretical Investigation of Stilbene as Photochromic Spin CouplerPAL, AK; HANSDA, S; DATTA, SN; ILLAS, F
2011Theoretical study of the relative stability of Si(8)H(8-n)Li(n)(n=0-8) clusters: Investigating the roles of isoelectronic H and Li atomsSAHU, S
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