Please use this identifier to cite or link to this item:
http://idr.niser.ac.in:8080/jspui/handle/123456789/323| Title: | Computational studies of aromatic substitution and gas-surface reactions |
| Authors: | Sharma, Nishant Lourderaj, Upakarasamy |
| Keywords: | Kinetic Energy Gas-Surface Interaction Gibbs Free Ennergy Born- Oppenheimer (BO) Approximation Electron- Electron Repulsion Pauli Exclusion Principle Density Functional Theory (DFT) Equations of Motion (EOM) Electrophilic Aromatic Substitution Cyclopentadienyl (Cp) Rings |
| Issue Date: | 12-Apr-2022 |
| Publisher: | School of Chemical Sciences, NISER, Bhubaneswar |
| Series/Report no.: | T201; |
| URI: | http://idr.niser.ac.in:8080/jspui/handle/123456789/323 |
| Appears in Collections: | School of Chemical Sciences |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| T201_NISHANT_SHARMA_CHEM11201504004.pdf | 42.55 MB | Adobe PDF | View/Open |
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