| Two Closely Related Zn(II)-MOFs for Their Large Difference in CO2 Uptake Capacities and Selective CO2 Sorption S Chand, A Pal, R Saha, P Das, R Sahoo, PK Chattaraj, MC Das Inorg. Chem. 59 (10), 7056-7066, 2020 | 35 | 2020 |
| Encapsulation of Mg2 inside a C60 cage forms an electride P Das, R Saha, PK Chattaraj Journal of Computational Chemistry 41 (17), 1645-1653, 2020 | 26 | 2020 |
| Electride Characteristics of Some Binuclear Sandwich Complexes of Alkaline Earth Metals, M2 (η5-L) 2 (M= Be, Mg; L= C5H5–, N5–, P5–, As5–) P Das, PK Chattaraj The Journal of Physical Chemistry A 124, 9801-9810, 2020 | 19 | 2020 |
| CSinGe4−n2+ (n = 1-3): Prospective Systems Containing Planar Tetracoordinate Carbon (ptC) P Das, M Khatun, A Anakuthil, PK Chattaraj Physical Chemistry Chemical Physics 24, 16701-16711, 2022 | 17 | 2022 |
| In Silico Studies on Selected Neutral Molecules, CGa2Ge2, CAlGaGe2 and CSiGa2Ge Containing Planar Tetracoordinate Carbon P Das, PK Chattaraj Atoms 9 (3), 65, 2021 | 17 | 2021 |
| CSiGaAl2−/0 and CGeGaAl2−/0 having planar tetracoordinate carbon atoms in their global minimum energy structures P Das, PK Chattaraj Journal of Computational Chemistry 43 (13), 894-905, 2022 | 15 | 2022 |
| A Complex Containing Four Magnesium Atoms and Two Mg-Mg Bonds Behaving as an Electride R Saha, P Das, PK Chattaraj Eur. J. Inorg. Chem. 2019 (38), 4105–4111, 2019 | 14 | 2019 |
| Comparison Between Electride Characteristics of Li3@B40 and Li3@C60 P Das, PK Chattaraj Frontiers in chemistry 9, 95, 2021 | 12 | 2021 |
| CB6Al0/+: Planar Hexacoordinate Boron (phB) in The Global Minimum Structure P Das, SG Patra, PK Chattaraj Physical Chemistry Chemical Physics 24, 22634-22644, 2022 | 11 | 2022 |
| Substituent Effects on Electride Characteristics of Mg2(η5-C5H5)2: A Theoretical Study P Das, PK Chattaraj The Journal of Physical Chemistry A 125 (28), 6207−6220, 2021 | 10 | 2021 |
| Structure and Bonding in Planar Hypercoordinate Carbon Compounds P Das, PK Chattaraj Chemistry 4 (4), 1723-1756, 2022 | 9 | 2022 |
| Possible C-F Bond Activation by B(C6F5)3/Lutidine and Al(C6F5)3/Lutidine Frustrated Lewis Pair : An In Silico Study M Ghara, S Giri, P Das, PK Chattaraj J. Chem. Sci. 134, 1-12, 2022 | 9 | 2022 |
| Molecular Electrides: An in silico Perspective R Saha, P Das, PK Chattaraj ChemPhysChem 23 (23), e202200329, 2022 | 5 | 2022 |
| Electride characteristics of M2(η5-E5) 2 (M= Be, Mg; E= Sb5-) P Das, PK Chattaraj Structural Chemistry 32, 2107–2114, 2021 | 5 | 2021 |
| BSinGe4-n+ (n = 0-2): Prospective Systems Containing Planar Tetracoordinate Boron (ptB) P Das, PK Chattaraj Journal of Chemical Sciences 135 (1), 1-12, 2022 | 4 | 2022 |
| Stabilization of Li(0)-Li(0) Bond by Normal and Mesoionic Carbenes and Electride Characteristics of The Complexes P Das, PK Chattaraj Molecular Physics, e2026512, 2022 | 4 | 2022 |
| Global Optimization: A Soft Computing Perspective R Pal, P Das, PK Chattaraj The Journal of Physical Chemistry Letters 14, 3468-3482, 2023 | 2 | 2023 |
| Planar Hypercoordinate Carbon P Das, S Pan, PK Chattaraj Atomic Clusters with Unusual Structure, Bonding and Reactivity, 357-372, 2023 | 2 | 2023 |
| Metal-Metal Bonds with Unusual Oxidation States in Early s-Block Elements: A Computational Perspective P Das, R Saha, PK Chattaraj Polyhedron, 116661, 2023 | 1 | 2023 |
| Hydrogen Trapping Potential of a Few Novel Molecular Clusters and Ions S Mondal, P Das, S Giri Atomic Clusters with Unusual Structure, Bonding and Reactivity, 297-312, 2023 | 1 | 2023 |
Pratim Kumar ChattarajDistinguished Visiting Professor, Department of Chemistry, Birla Institute of Technology MesraDirección de correo verificada de bitmesra.ac.in
