Theoretical prediction of HRgCO + ion ( Rg = He , Ne, Ar, Kr, and Xe) von Jayasekharan, T., Ghanty, T. K.

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Structure and stability of xenon insertion compounds of hypohalous acids, HXeOX [X=F, Cl, and Br]: an ab initio investigation von Jayasekharan, T, Ghanty, T K

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Antioxidant Activity of Bakuchiol:  Experimental Evidences and Theoretical Treatments on the Possible Involvement of the Terpenoid Chain von Adhikari, S, Joshi, R, Patro, B. S, Ghanty, T. K, Chintalwar, G. J, Sharma, A, Chattopadhyay, S, Mukherjee, T

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Endohedrally Doped Golden Fullerenes [X@Au32] (X = Li+, Na+, K+, Rb+, Cs+) von Jayasekharan, T, Ghanty, T. K

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Prediction of metastable metal-rare gas fluorides:FMRgF ( M = Be and Mg; Rg = Ar , Kr and Xe) von Jayasekharan, T., Ghanty, T. K.

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Is molecular rotation really influenced by subtle changes in molecular shape? von Dutt, G B, Ghanty, T K

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Rotational Dynamics of Nondipolar Probes in Butanols:  Correlation of Reorientation Times with Solute−Solvent Interaction Strengths von Dutt, G. B, Ghanty, T. K

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Rotational Diffusion of Coumarins in Electrolyte Solutions:  The Role of Ion Pairs von Dutt, G. B, Ghanty, T. K

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Theoretical investigation of rare gas hydride cations: HRgN2+ (Rg=He, Ar, Kr, and Xe) von Jayasekharan, T, Ghanty, T K

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Insertion of rare gas atoms into BF3 and AlF3 molecules: an ab initio investigation von Jayasekharan, T, Ghanty, T K

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The van der Waals coefficients between carbon nanostructures and small molecules: A time-dependent density functional theory study von Kamal, C, Ghanty, T K, Banerjee, Arup, Chakrabarti, Aparna

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Thermodynamic study of Eu(III) complexation by pyridine monocarboxylates von Rama Mohana Rao, D., Rawat, Neetika, Sawant, R.M., Manna, D., Ghanty, T.K., Tomar, B.S.

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Complexation of thorium with pyridine monocarboxylates: A thermodynamic study by experiment and theory von Rama Mohana Rao, D., Rawat, Neetika, Manna, D., Sawant, R.M., Ghanty, T.K., Tomar, B.S.

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Thermodynamics of U(VI) and Eu(III) complexation by unsaturated carboxylates von Rawat, Neetika, Bhattacharyya, A., Tomar, B.S., Ghanty, T.K., Manchanda, V.K.

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Structure-property correlation study through sum-over-state approach von Nandi, P K, Hatua, K, Bansh, A K, Panja, N, Ghanty, T K

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Theoretical investigation of rare gas hydride cations: HRgN 2 + (Rg=He, Ar, Kr, and Xe) von Jayasekharan, T., Ghanty, T. K.

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Rotational dynamics of nondipolar probes in ethanols: How does the strength of the solute–solvent hydrogen bond impede molecular rotation? von Dutt, G. B., Ghanty, T. K.

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Rotational dynamics of nondipolar probes in associative solvents: Modeling of hydrogen bonding interactions using the extended charge distribution theory of dielectric friction von Dutt, G. B., Ghanty, T. K.

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Rotational dynamics of nondipolar probes in electrolyte solutions: Can specific interactions be modeled as dielectric friction? von Dutt, G. B., Ghanty, T. K.

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Exothermic, sluggish biphasic extraction of uranyl through polygonal bipyramidal chloroacetamide complexes in ionic liquid von Bhatt, Aditya Madan, Ludbe, Nidhi, Ghosh, Ayan, Srivastava, Ashutosh, Chauhan, Rohit Singh, Sengupta, Arijit, Ghanty, T.K.

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