A computational investigation of the activation of allene (H2C = C = CHR; R = H, CH3, CN) by a frustrated phosphorous/boron Lewis pair

Pratim Kumar Chattaraj , Pratim Kumar Chattaraj , Manas Ghara , Himangshu Mondal
Chemical Physics Letters 774 138623

2021
A computational study on hydrogenation of CO2, catalyzed by a bridged B/N frustrated Lewis pair

Manas Ghara , Pratim K. Chattaraj
Structural Chemistry 30 ( 3) 1067 -1077

6
2019
Cycloaddition Reactions between H2C = CHR (R = H, CN, CH3) and a Cyclic P/B Frustrated Lewis Pair: A DFT Study.

Manas Ghara , Santanab Giri , Pratim Kumar Chattaraj
Journal of Physical Chemistry A 124 ( 22) 4455 -4462

15
2020
Confinement induced catalytic activity in a Diels-Alder reaction: comparison among various CB[n], n = 6-8, cavitands.

Manas Ghara , Debdutta Chakraborty , Pratim K. Chattaraj
Journal of Molecular Modeling 24 ( 9) 228

5
2018
Noble Gas Binding Ability of an Au(I) Cation Stabilized by a Frustrated Lewis Pair: A DFT Study

Manas Ghara , Pratim Kumar Chattaraj
Frontiers in Chemistry 8 616

2
2020
Noble gas bound beryllium chromate and beryllium hydrogen phosphate: a comparison with noble gas bound beryllium oxide

Sudip Pan , Manas Ghara , Sreyan Ghosh , Pratim K. Chattaraj
RSC Advances 6 ( 95) 92786 -92794

13
2016
Hydrogen trapping potential of (HF)m (m=1–8) and (H2O)n (n=1–10) clusters

Sukanta Mondal , Manas Ghara , Pratim Kumar Chattaraj
Computational and Theoretical Chemistry 1071 18 -26

1
2015
Exohedral complexation of B39- with ECp∗+ half-sandwich complexes (ESi, Ge, Sn, Pb): A DFT study

Ayan Majumder , Manas Ghara , Pratim K. Chattaraj
Computational and Theoretical Chemistry 1140 49 -55

1
2018
Donor-Acceptor vs Electron-Shared Bonding: Triatomic SinC3-n (n ≤ 3) Clusters Stabilized by Cyclic Alkyl(amino) Carbene.

Manas Ghara , Sudip Pan , Pratim K. Chattaraj
Journal of Physical Chemistry A 123 ( 50) 10764 -10771

2
2019
Fixation of nitrous oxide (N2O) by 1, 4, 2, 5‐diazadiborinine: A DFT study

Manas Ghara , Pratim K. Chattaraj
International Journal of Quantum Chemistry 118 ( 14)

7
2018
Noble gas encapsulated B40 cage

Sudip Pan , Manas Ghara , Susmita Kar , Ximena Zarate
Physical Chemistry Chemical Physics 20 ( 3) 1953 -1963

18
2018
21
2019
Activation of small molecules and hydrogenation of CO2 catalyzed by frustrated Lewis pairs

Ranita Pal , Manas Ghara , Pratim Kumar Chattaraj
Catalysts 12 ( 2) 201

8
2022
Possible CF bond activation by B (C6F5) 3/lutidine and Al (C6F5) 3/lutidine frustrated Lewis pair: an in silico study

Manas Ghara , Santanab Giri , Prasenjit Das , Pratim Kumar Chattaraj
Journal of Chemical Sciences 134 ( 1) 14

6
2022
Application of frustrated Lewis pairs in small molecule activation and associated transformations

Dandan Jiang , Manas Ghara , Sudip Pan , Lili Zhao
Smpte Journal 387 -410

2023
Structure, stability, and nature of bonding in carbon monoxide bound complexes (E= group 14 element; X= H, F, Cl, Br, I)

Manas Ghara , Sudip Pan , Anand Kumar , Gabriel Merino
Journal of Computational Chemistry 37 ( 24) 2202 -2211

13
2016
Frustrated Lewis Pairs: Bonding, Reactivity, and Applications

Manas Ghara , Himangshu Mondal , Ranita Pal , Pratim Kumar Chattaraj
The Journal of Physical Chemistry A 127 ( 21) 4561 -4582

10
2023
A DFT study on trapping of nitric oxide by 1, 3, 2, 5-diazadiborinine, a frustrated Lewis pair

Manas Ghara , Pratim K Chattaraj
J. Indian Chem. Soc 95 1019 -1019

7
2018
Bonding and Reactivity in RB-AsR Systems (R= H, F, OH, CH3, CMe3, CF3, SiF3, BO): Substituent Effects

Manas Ghara , Pratim K Chattaraj , GHARA Manas , K CHATTARAJ Pratim
物理化学学报 34 ( 2) 201 -207

2
2017