Correlation between hardness, polarizability, and size of atoms, molecules, and clusters TK Ghanty, SK Ghosh The Journal of Physical Chemistry 97 (19), 4951-4953, 1993 | 305 | 1993 |
Is the hydrogen bond in water dimer and ice covalent? TK Ghanty, VN Staroverov, PR Koren, ER Davidson Journal of the American Chemical Society 122 (6), 1210-1214, 2000 | 224 | 2000 |
A density functional approach to hardness, polarizability, and valency of molecules in chemical reactions TK Ghanty, SK Ghosh The Journal of Physical Chemistry 100 (30), 12295-12298, 1996 | 223 | 1996 |
Spin-polarized generalization of the concepts of electronegativity and hardness and the description of chemical binding TK Ghanty, SK Ghosh Journal of the American Chemical Society 116 (9), 3943-3948, 1994 | 127 | 1994 |
Relationship between ionization potential, polarizability, and softness: a case study of lithium and sodium metal clusters KRS Chandrakumar, TK Ghanty, SK Ghosh The Journal of Physical Chemistry A 108 (32), 6661-6666, 2004 | 113 | 2004 |
Ultrafast intermolecular hydrogen bond dynamics in the excited state of fluorenone V Samant, AK Singh, G Ramakrishna, HN Ghosh, TK Ghanty, DK Palit The Journal of Physical Chemistry A 109 (39), 8693-8704, 2005 | 109 | 2005 |
Antioxidant activity of bakuchiol: experimental evidences and theoretical treatments on the possible involvement of the terpenoid chain S Adhikari, R Joshi, BS Patro, TK Ghanty, GJ Chintalwar, A Sharma, ... Chemical Research in Toxicology 16 (9), 1062-1069, 2003 | 107 | 2003 |
Selective americium (III) complexation by dithiophosphinates: a density functional theoretical validation for covalent interactions responsible for unusual separation behavior … A Bhattacharyya, TK Ghanty, PK Mohapatra, VK Manchanda Inorganic Chemistry 50 (9), 3913-3921, 2011 | 94 | 2011 |
Insertion of noble-gas atom (Kr and Xe) into noble-metal molecules (AuF and AuOH): Are they stable? TK Ghanty The Journal of Chemical Physics 123, 074323, 2005 | 85 | 2005 |
Actinide selectivity of 1, 10-phenanthroline-2, 9-dicarboxamide and its derivatives: a theoretical prediction followed by experimental validation D Manna, S Mula, A Bhattacharyya, S Chattopadhyay, TK Ghanty Dalton Transactions 44 (3), 1332-1340, 2015 | 81 | 2015 |
How strong is the interaction between a noble gas atom and a noble metal atom in the insertion compounds MNgF (M= Cu and Ag, and Ng= Ar, Kr, and Xe)? TK Ghanty The Journal of Chemical Physics 124, 124304, 2006 | 81 | 2006 |
Complexation behavior of trivalent actinides and lanthanides with 1, 10-phenanthroline-2, 9-dicarboxylic acid based ligands: insight from density functional theory D Manna, TK Ghanty Physical Chemistry Chemical Physics 14 (31), 11060-11069, 2012 | 79 | 2012 |
New scale of atomic orbital radii and its relationship with polarizability, electronegativity, other atomic properties, and bond energies of diatomic molecules TK Ghanty, SK Ghosh The Journal of Physical Chemistry 100 (43), 17429-17433, 1996 | 78 | 1996 |
Structures and the Electronic Properties of Au19X Clusters (X = Li, Na, K, Rb, Cs, Cu, and Ag) TK Ghanty, A Banerjee, A Chakrabarti The Journal of Physical Chemistry C 114 (1), 20-27, 2010 | 75 | 2010 |
Simple density functional approach to polarizability, hardness, and covalent radius of atomic systems TK Ghanty, SK Ghosh The Journal of Physical Chemistry 98 (37), 9197-9201, 1994 | 72 | 1994 |
Static dipole polarizability and binding energy of sodium clusters Na (n= 1–10): A critical assessment of all-electron based post Hartree–Fock and density functional methods KRS Chandrakumar, TK Ghanty, SK Ghosh The Journal of Chemical Physics 120 (14), 6487-6494, 2004 | 69 | 2004 |
Rational design of boradiazaindacene (bodipy)‐based functional molecules M Gupta, S Mula, M Tyagi, TK Ghanty, S Murudkar, AK Ray, ... Chemistry–A European Journal 19 (52), 17766-17772, 2013 | 60 | 2013 |
Polarizability of water clusters: An ab initio investigation TK Ghanty, SK Ghosh The Journal of Chemical Physics (COMMUNICATION) 118 (19), 8547-8550, 2003 | 60 | 2003 |
Steric Strain Release-Directed Regioselective Functionalization of meso-Methyl Bodipy Dyes N Shivran, S Mula, TK Ghanty, S Chattopadhyay Organic Letters 13 (21), 5870-5873, 2011 | 56 | 2011 |
Electronegativity and covalent binding in homonuclear diatomic molecules TK Ghanty, SK Ghosh The Journal of Physical Chemistry 95 (17), 6512-6514, 1991 | 56 | 1991 |