Aleksandr A Chamkin

5PUBLICATIONS
15CO-AUTHORS
Theoretical quantum chemistryComputational chemistryChemical and thermal processes in energy and combustion
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Publications (5)

|Sep 11, 2025
Accurate Theoretical Assessment of MLCT Transitions in [M(Terpy)2]2+ (M = Fe, Ru, Os) Complexes.

Aleksandr A Chamkin, Elena S Chamkina

|Jul 25, 2024
Assessment of the applicability of DFT methods to [Cp*Rh]-catalyzed hydrogen evolution processes.

Aleksandr A Chamkin, Elena S Chamkina

|Apr 24, 2024
From a humorous post to a detailed quantum-chemical study: isocyanate synthesis revisited.

Oleg B Beletsan, Igor Gordiy, Sergey S Lunkov

|Oct 05, 2023
A larger basis set describes atomization energy core-valence correction better than a higher-order coupled-cluster method.

Aleksandr A Chamkin, Elena S Chamkina

|Aug 20, 2020
DFT, DLPNO-CCSD(T), and NEVPT2 benchmark study of the reaction between ferrocenium and trimethylphosphine.

Aleksandr A Chamkin, Elena S Serkova

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