Srimanta Pakhira

activity

20162024

most citedUnveiling the Role of 2D Monolayer Mn-doped MoS

_{2}

Material: Toward an Efficient Electrocatalyst for H

_{2}

Evolution Reaction

41 citations · 160 across the 20 of their papers we have counts for

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physics.chem-ph2021

Relativistic Quantum Calculations to Understand the Contribution of f-Orbitals and Chemical Bonding of Actinides with Organic Ligands

Andy D. Zapata-Escobar, Srimanta Pakhira, Joaquin Barroso-Flores +2

The nuclear waste problem is one of the main interests of the rare earth and actinide elements chemistry. Studies of Actinide-containing compounds are at the frontier of the applic…

physics.chem-ph2018★ 23 cited

Reaction Mechanism of the Selective Reduction of CO $_{2}$ to CO by a Tetraaza [Co $^{II}$ N $_{4}$ H] $^{2 +}$ Complex in the Presence of Protons

Alejandro J. Garza, Srimanta Pakhira, Alexis T. Bell +2

The tetraaza [Co $^{II}$ N $_{4}$ H] $^{2 +}$ complex (\textbf{1}) is remarkable for its ability to selectively reduce CO $_{2}$ to CO with 45\% Faradaic efficiency and a CO to H $_{2}$ rat…

Relativistic Quantum Calculations to Understand the Contribution of f-Orbitals and Chemical Bonding of Actinides with Organic Ligands

Reaction Mechanism of the Selective Reduction of CO2​ to CO by a Tetraaza [CoIIN4​H]2+ Complex in the Presence of Protons

Reaction Mechanism of the Selective Reduction of CO $_{2}$ to CO by a Tetraaza [Co $^{II}$ N $_{4}$ H] $^{2 +}$ Complex in the Presence of Protons