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Department of Chemistry, Visva-Bharati, Santiniketan 731235, India
Journal Articles
18. Machine Learning Accelerated First-Principles Study of the Hydrodeoxygenation of Propanoic Acid
W Yang, KE Abdelfatah, SK Kundu, B Rajbanshi, GA Terejanu, A Heyden*
ACS Catalysis 14, 10148-10163 (2024).
17. Accurate Determination of Materials Properties: Role of Electron Density
A Pramanik, S Ghoshal, S Biswas, B Rajbanshi, P Sarkar*
JElectron Density: Concepts, Computation and DFT Applications, 329 (2024).
16. Mechanistic study of heterogeneous propene metathesis on WOx/SiO2 catalysts
Anne V Le, Biplab Rajbanshi, Raul F Lobo, Peng Bai*
Journal of Catalysis 427, 115117 (2023).
15. Propane Dehydrogenation on Platinum Catalysts: Identifying the Active Sites through Bayesian Analysis
Charles Fricke, Biplab Rajbanshi, Eric A Walker, Gabriel Terejanu*, Andreas Heyden*
ACS Catalysis 12, 2487-2498 (2022).
14. Nitrogen-Doped Lithium Lanthanum Titanate Nanofiber-Polymer Composite Electrolytes for All-Solid-State Lithium Batteries
Hui Yang, Kieran Tay, Yaobin Xu, Biplab Rajbanshi, Sujan Kasani, Joeseph Bright, Jennifer Boryczka, Chongmin Wang, Peng Bai, Nianqiang Wu*
Journal of The Electrochemical Society 168 (11), 110507 (2021).
13. Computational Investigation of the Catalytic Hydrodeoxygenation of Propanoic Acid over a Cu(111) Surface
Biplab Rajbanshi, Wenqiang Yang, Adam Yonge, Subrata Kumar Kundu, Charles Fricke, Andreas. Heyden*
The Journal of Physical Chemistry C, 125 (35), 19276-19293 (2021).
12. Oxidative Dehydrogenation of Propane on the Oxygen Adsorbed Edges of Boron Nitride Nanoribbons
Biplab Rajbanshi, Supriya Saha, Charles Fricke, Salai C. Ammal, Andreas. Heyden*
Catalysis Science & Technology 10, 5181-5195 (2020).
11. Oxidative Dehydrogenation of Propane on Boron Nitride Catalyst: A Computational Investigation of Active Site As Well As Involved Mechanism Using Boron Nitride Nanoribbons
Andreas Heyden, Biplab Rajbanshi
2019 AIChE Annual Meeting.
10. Prediction of transition-state energies of hydrodeoxygenation reactions on transition-metal surfaces based on machine learning
Kareem Abdelfatah, Wenqiang Yang, Rajadurai Vijay Solomon, Biplab Rajbanshi, Asif Chowdhury, Mehdi Zare, Subrata Kumar Kundu, Adam Yonge, Andreas Heyden*, Gabriel Terejanu*
The Journal of Physical Chemistry C 123 (49), 29804-29810 (2019).
9. Periodically-ordered one and two dimensional CdTe QD superstructures: a path forward in photovoltaics
Moumita Kar, Biplab Rajbanshi, Ritabrata Sarkar, Sougata Pal, Pranab Sarkar*
Physical Chemistry Chemical Physics 21 (35), 19391-19402 (2019).
8. Engineering the electronic structure of tin sulfide nanoribbons: A computational study
Moumita Kar, Biplab Rajbanshi, Sougata Pal, Pranab Sarkar*
The Journal of Physical Chemistry C 122 (10), 5731-5741 (2018).
7. Phosphorene quantum dot-fullerene nanocomposites for solar energy conversion: An unexplored inorganic-organic nanohybrid with novel photovoltaic properties
Biplab Rajbanshi, Moumita Kar, Pallavi Sarkar, Pranab Sarkar*
Chemical Physics Letters 685, 16-22 (2017).
6. Is the Metallic Phosphorus Carbide (β0-PC) Monolayer Stable? An Answer from a Theoretical Perspective
Biplab Rajbanshi, Pranab Sarkar*
The Journal of Physical Chemistry Letters 8 (4), 747-754 (2017).
5. Optimizing the photovoltaic properties of CdTe quantum dot–porphyrin nanocomposites: a theoretical study
Biplab Rajbanshi, Pranab Sarkar*
The Journal of Physical Chemistry C 120 (32), 17878-17886 (2016).
4. Energetic and electronic structure of penta-graphene nanoribbons
Biplab Rajbanshi, Sunandan Sarkar, Bikash Mandal, Pranab Sarkar*
Carbon 100, 118-125 (2016)
3. The electronic and optical properties of MoS 2 (1− x) Se 2x and MoS 2 (1− x) Te 2x monolayers
Biplab Rajbanshi, Sunandan Sarkar, Pranab Sarkar*
Physical Chemistry Chemical Physics 17 (39), 26166-26174 (2015).
2. Understanding the electronic structure of CdSe quantum dot-fullerene (C60) hybrid nanostructure for photovoltaic applications
Sunandan Sarkar, Biplab Rajbanshi, Pranab Sarkar*
Journal of Applied Physics 116 (11), 114303 (2014).
1. Band gap engineering of graphene–CdTe quantum dot hybrid nanostructures
Biplab Rajbanshi, Sunandan Sarkar, Pranab Sarkar*
Journal of Materials Chemistry C 2 (42), 8967-8975 (2014).
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