P. Samanta

activity

20162023

most citedNECI: N-Electron Configuration Interaction with emphasis on state-of-the-art stochastic methods

99 citations · 155 across the 3 of their papers we have counts for

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physics.chem-ph2023

Accurate determination of excitation energy: An equation-of-motion approach over a bi-exponential Coupled Cluster theory

Anish Chakraborty, Pradipta Kumar Samanta, Rahul Maitra

The calculation of molecular excited states is critically important to decipher a plethora of molecular properties. In this manuscript, we develop an equation of motion formalism o…

physics.chem-ph2016★ 56 cited

Quantum tunneling during interstellar surface-catalyzed formation of water: the reaction H + H $_{2}$ O $_{2}$ $\to$ H $_{2}$ O + OH

Thanja Lamberts, Pradipta Kumar Samanta, Andreas Köhn +1

The final step of the water formation network on interstellar grain surfaces starting from the H + O $_{2}$ route is the reaction between H and H $_{2}$ O $_{2}$ . This reaction is known to h…

Accurate determination of excitation energy: An equation-of-motion approach over a bi-exponential Coupled Cluster theory

Quantum tunneling during interstellar surface-catalyzed formation of water: the reaction H + H2​O2​ → H2​O + OH

Quantum tunneling during interstellar surface-catalyzed formation of water: the reaction H + H $_{2}$ O $_{2}$ $\to$ H $_{2}$ O + OH