| 1 |
Reactivity Dynamics
Sarkar U, Chattaraj PK
Journal of Physical Chemistry A, 125(10), 2051, 2021 |
| 2 |
Metal-Organic Frameworks of Cu(II) Constructed from Functionalized Ligands for High Capacity H-2 and CO2 Gas Adsorption and Catalytic Studies
Gupta M, Chatterjee N, De D, Saha R, Chattaraj PK, Oliver CL, Bharadwaj PK
Inorganic Chemistry, 59(3), 1810, 2020 |
| 3 |
Two Closely Related Zn(II)-MOFs for Their Large Difference in CO(2 )Uptake Capacities and Selective CO2 Sorption
Chand S, Pal A, Saha R, Das P, Sahoo R, Chattaraj PK, Das MC
Inorganic Chemistry, 59(10), 7056, 2020 |
| 4 |
Tribute to Paul Geerlings
Ayers PW, Chattaraj PK, De Proft F, Toro-Labbe A
Journal of Physical Chemistry A, 124(25), 5061, 2020 |
| 5 |
Cycloaddition Reactions between H2C = CHR (R = H, CN, CH3) and a Cyclic P/B Frustrated Lewis Pair: A DFT Study
Ghara M, Giri S, Chattaraj PK
Journal of Physical Chemistry A, 124(22), 4455, 2020 |
| 6 |
Electride Characteristics of Some Binuclear Sandwich Complexes of Alkaline Earth Metals, M-2(eta(5)-L)(2) (M = Be, Mg; L = C5H5-, N-5(-), P-5(-), As-5(-))
Das P, Chattaraj PK
Journal of Physical Chemistry A, 124(47), 9801, 2020 |
| 7 |
Fast "ES-Click" Reaction Involving Furfuryl and Triazolinedione Functionalities toward Designing a Healable Polymethacrylate
Mondal P, Jana G, Behera PK, Chattaraj PK, Singha NK
Macromolecules, 53(19), 8313, 2020 |
| 8 |
Is It Possible To Determine Oxidation States for Atoms in Molecules Using Density-Based Quantities? An Information-Theoretic Approach and Conceptual Density Functional Theory Study
Wu JY, Yu DH, Liu SY, Rong CY, Zhong AG, Chattaraj PK, Liu SB
Journal of Physical Chemistry A, 123(31), 6751, 2019 |
| 9 |
Donor-Acceptor vs Electron-Shared Bonding: Triatomic Si(n)C(3-)n (n <= 3) Clusters Stabilized by Cyclic Alkyl(amino) Carbene
Ghara M, Pan S, Chattaraj PK
Journal of Physical Chemistry A, 123(50), 10764, 2019 |
| 10 |
A possible reason behind the initial formation of pentagonal dodecahedron cavities in sI-methane hydrate nucleation: A DFT study
Mondal S, Goswami T, Jana G, Misra A, Chattaraj PK
Chemical Physics Letters, 691, 415, 2018 |
