Rajendra R Zope

11PUBLICATIONS
25CO-AUTHORS
Catalysis and mechanisms of reactionsNonlinear optics and spectroscopyTheoretical quantum chemistryChemical thermodynamics and energeticsRadiation and matter
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Publications (11)

|Jul 20, 2026
Assessing Self-Interaction Corrections in the Selective Catalytic Reduction of NO on a Cu-SSZ-13 Zeolite Cluster Model.

|Dec 11, 2025
Polarizability of Polymers Using One-Electron Self-Interaction-Corrected Density Functional Methods.

Prakash Mishra, Yoh Yamamoto, Peter Ufondu

|Aug 12, 2025
Simplification of the Fermi-Löwdin Self-Interaction Correction Method for Efficient Self-Interaction-Free Density Functional Calculations.

Selim Romero, Yoh Yamamoto, Tunna Baruah

|Feb 22, 2024
How well do one-electron self-interaction-correction methods perform for systems with fractional electrons?

Rajendra R Zope, Yoh Yamamoto, Tunna Baruah

|Oct 20, 2023
Use of FLOSIC for understanding anion-solvent interactions.

Mark R Pederson, Kushantha P K Withanage, Zahra Hooshmand

|Apr 25, 2023
Vertical detachment energies of ammonia cluster anions using self-interaction-corrected methods.

Peter Ufondu, Po-Hao Chang, Tunna Baruah

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Frequent Collaborators

8 joint publications

Tunna Baruah

6 joint publications

Yoh Yamamoto

3 joint publications

Koblar A Jackson

3 joint publications

Selim Romero