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cond-mat.mtrl-sci2026
Correlated-Electron Theory of Triplet-Triplet Multiexciton States in Polypentacene
Rupali Jindal, Alok Shukla, Sumit Mazumdar
We present correlated-electron calculations of optical spin-singlet and triplet-triplet multiexciton states in three- and four-unit pentacene oligomers as microscopic models for po…
cond-mat.mtrl-sci2024
First-Principles Study of Penta-CN2 Quantum Dots for Efficient Hydrogen Evolution Reaction
Rupali Jindal, Rachana Yogi, Alok Shukla
The objective of our research is to investigate the electrocatalytic properties of novel metal-free quantum dots (QDs) composed of the recently discovered 2D material penta-CN2, wi…