| Alkali-metal-induced enhancement of hydrogen adsorption in C60 fullerene: an ab initio study KRS Chandrakumar, SK Ghosh Nano letters 8 (1), 13-19, 2008 | 412 | 2008 |
| Critical study of local reactivity descriptors for weak interactions: Qualitative and quantitative analysis of adsorption of molecules in the zeolite lattice S Pal, KRS Chandrakumar Journal of the American Chemical Society 122 (17), 4145-4153, 2000 | 143 | 2000 |
| 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 | 112 | 2004 |
| The concept of density functional theory based descriptors and its relation with the reactivity of molecular systems: A semi-quantitative study KRS Chandrakumar, S Pal International Journal of Molecular Sciences 3 (4), 324-337, 2002 | 96 | 2002 |
| Microwave specific Wolff rearrangement of α-diazoketones and its relevance to the nonthermal and thermal effect SG Sudrik, SP Chavan, KRS Chandrakumar, S Pal, SK Date, SP Chavan, ... The Journal of Organic Chemistry 67 (5), 1574-1579, 2002 | 78 | 2002 |
| SWNT Nucleation from Carbon-Coated SiO2 Nanoparticles via a Vapor−Solid−Solid Mechanism AJ Page, KRS Chandrakumar, S Irle, K Morokuma Journal of the American Chemical Society 133 (3), 621-628, 2011 | 70 | 2011 |
| Static dipole polarizability and binding energy of sodium clusters A critical assessment of all-electron based post Hartree–Fock and density functional … KRS Chandrakumar, TK Ghanty, SK Ghosh The Journal of chemical physics 120 (14), 6487-6494, 2004 | 69 | 2004 |
| Study of Local Hard− Soft Acid− Base Principle to Multiple-Site Interactions KRS Chandrakumar, S Pal The Journal of Physical Chemistry A 106 (23), 5737-5744, 2002 | 66 | 2002 |
| Nanoscale curvature-induced hydrogen adsorption in alkali metal doped carbon nanomaterials KRS Chandrakumar, K Srinivasu, SK Ghosh The Journal of Physical Chemistry C 112 (40), 15670-15679, 2008 | 63 | 2008 |
| Boron precursor-dependent evolution of differently emitting carbon dots J Jana, M Ganguly, KRS Chandrakumar, G Mohan Rao, T Pal Langmuir 33 (2), 573-584, 2017 | 59 | 2017 |
| Quantum chemical studies on hydrogen adsorption in carbon-based model systems: role of charged surface and the electronic induction effect K Srinivasu, KRS Chandrakumar, SK Ghosh Physical Chemistry Chemical Physics 10 (38), 5832-5839, 2008 | 56 | 2008 |
| The influence of electric field on the global and local reactivity descriptors: reactivity and stability of weakly bonded complexes R Kar, KRS Chandrakumar, S Pal The Journal of Physical Chemistry A 111 (2), 375-383, 2007 | 53 | 2007 |
| A systematic study on the reactivity of Lewis acid− base complexes through the local hard− soft acid− base principle KRS Chandrakumar, S Pal The Journal of Physical Chemistry A 106 (48), 11775-11781, 2002 | 53 | 2002 |
| Beyond the Gold–Hydrogen Analogy: Doping Gold Cluster with H-atom–O2 Activation and Reduction of the Reaction Barrier for CO Oxidation NK Jena, KRS Chandrakumar, SK Ghosh The Journal of Physical Chemistry Letters 2 (12), 1476-1480, 2011 | 48 | 2011 |
| Computational Investigation of Hydrogen Adsorption by Alkali‐Metal‐Doped Organic Molecules: Role of Aromaticity K Srinivasu, KRS Chandrakumar, SK Ghosh ChemPhysChem 10 (2), 427-435, 2009 | 48 | 2009 |
| Theoretical investigation on the structure and electronic properties of hydrogen-and alkali-metal-doped gold clusters and their interaction with CO: enhanced reactivity of … NK Jena, KRS Chandrakumar, SK Ghosh The Journal of Physical Chemistry C 113 (41), 17885-17892, 2009 | 41 | 2009 |
| Thermally Activated Delayed Fluorescence (Green) in Undoped Film and Exciplex Emission (Blue) in Acridone–Carbazole Derivatives for OLEDs QT Siddiqui, AA Awasthi, P Bhui, M Muneer, KRS Chandrakumar, S Bose, ... The Journal of Physical Chemistry C 123 (2), 1003-1014, 2018 | 40 | 2018 |
| Electrostatics driven interaction of dihydrogen with s-block metal cations: theoretical prediction of stable MH16 complex KRS Chandrakumar, SK Ghosh Chemical Physics Letters 447 (4-6), 208-214, 2007 | 40 | 2007 |
| Enhanced catalytic activity of Ag/Rh bimetallic nanomaterial: evidence of an ensemble effect A Roy, B Debnath, R Sahoo, KRS Chandrakumar, C Ray, J Jana, T Pal The Journal of Physical Chemistry C 120 (10), 5457-5467, 2016 | 39 | 2016 |
| Atomistic mechanism of carbon nanostructure self-assembly as predicted by nonequilibrium QM/MD simulations S Irle, AJ Page, B Saha, Y Wang, KRS Chandrakumar, Y Nishimoto, ... Practical Aspects of Computational Chemistry II: An Overview of the Last Two …, 2012 | 29 | 2012 |
Swapan K. GhoshUM-DAE-Centre for Excellence in Basic Science, University of Mumbai, IndiaVerified email at cbs.ac.in
