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Amitabh Joshi Anuranjan Anand Balasubramanian Sundaram C. P. Rajendran C.N.R Rao 
C.N.R Rao Chandrabhas Narayana Diwakar S. Venkatesan Eswaramoorthy MG.U. Kulkarni 
Ganesh Subramanian Govindaraju T H Ila Hemalatha Balaram James P. Clement Chelliah 
Jayanta Haldar K. B. Sinha K.S. Narayan Kanishka Biswas Kaustuv Sanyal 
Kavita Jain Krishnan V.Kundu Tapas K.M. R. S. Rao Maneesha Inamdar 
Meheboob Alam Meher K. Prakash Namita Surolia Narasimha Roddam Premkumar Senguttuvan 
Rajesh Ganapathy Ranjan Datta Ranjani Viswanatha Ravi Manjithaya S. N. Bhat 
Santosh Ansumali Santosh Ansumali Sarit S. Agasti Sebastian C Peter Sheeba Vasu 
Shivaprasad S. M.Shobhana Narasimhan Sreenivas K. R.Sridhar Rajaram Srikanth Sastry 
Subi Jacob George Subir K. Das Sundaresan A.Swapan Pati Tapas Kumar Maji 
Udaykumar Ranga Umesh V. Waghmare Valdiya K. S.Vidhyadhiraja N. S.Vidya T. N. C. 

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  1. Ayan Datta and Swapan K. Pati, Limit to puckering of benzene with sterically crowded molecules: Hexaferrocenylbenzene, Chemical Physics Letters 433, 67 (2006).

  2. B. Muralid haran, A. W. Ghosh, Swapan Pati and S. Datta, Are short molecules quantum dot arrays?, IEEE Conference on Nanotechnology 130, 1 (2006).

  3. A. Datta and Swapan K. Pati, Stability of Cyclic (H2O)n Clusters within Molecular Solids: Role of Aromaticity, Int. Jour. Quant. Chem. 106, 1697 (2006).

  4. S.Sarkar, Ayan Datta, A.Mondal, D.Chopra, J.Ribas, K.K.Rajak, Sairam S.M. and Swapan K. Pati, Competing Magnetic Interactions in a Dinuclear Ni(II) Complex: Antiferromagnetic O-H....O Moiety and Ferromagnetic N3- Ligand, J. Phys. Chem. B (Letters) 110, 12 (2006).

  5. A. Rehaman, Ayan Datta, Sairam S.M. and Swapan K. Pati, Quantifying Aromaticity at the Molecular and Supramolecular Limits: Comparing Homonuclear, Heteronuclear and H-Bonded Systems, J. Chem. Theory Comput. 2, 30 (2006).

  6. S. Natarajan, K. S. Narayan and Swapan K. Pati, Synthesis, structure and magnetic properties of the polyoxovanadate cluster [Zn2(NH2(CH2)2NH2)5][{Zn(NH2(CH2)2NH2)2}2{V18O42(H2O)}]-xH2O (x �?� 12), possessing a layered structure, J. Chem. Sci. 118, 57 (2006).

  7. Sairam S. M., Ayan Datta and Swapan K. Pati, Conformational Preference in Heteroatomic Analogues of Ethane, H3X-YH3 (X = B, Al; Y = N, P): Implications of Charge Transfer, J. Phys. Chem. 5156 (2006).

  8. Ayan Datta and Swapan K. Pati, Li and Be Clusters: Structure, bonding and odd-even effects in half-filled systems, Computing Letters 1(4), 271 (2006).

  9. Mohan P. J., Ayan Datta, Sairam S. M. and Swapan K. Pati, Structures of Nucleobases Trapped within Au Triangles and Its effects on Hydrogen Bonding in Base Pairs of DNA, J. Phys. Chem. B 110, 18661 (2006).

  10. Sheelan Sengupta, S. Lakshmi and Swapan K Pati, Effects of Dimerization and Spin Polarization on the Conductance of a Molecular wire, J. Phys. Cond. Mat. 18, 9189 (2006).

  11. Sairam S. Mallajosyula, Ayan Datta and Swapan K. Pati, Aromatic superclusters from all-metal aromatic and antiaromatic monomers, [Al4]2- and [Al4]4-, J. Phys. Chem. B. (Letters) 110, 20098 (2006).

  12. Ayan Datta and Swapan K. Pati, Dipolar Interactions and Hydrogen Bonding in Supramolecular Aggregates: Understanding Cooperative Phenomena for 1st Hyperpolarizability, Chemical Society Reviews 35, 1305 (2006).

  13. Reji Thomas, S. Lakshmi, Swapan K. Pati and G. U. Kulkarni, Role of triple bond in 1,2-diphenylacetylene crystal: A Combined Experimental and Theoretical Study, J. Phys. Chem. 24674 (2006).

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