23 citations · 61 across the 10 of their papers we have counts for
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physics.chem-ph2020★ 17 cited
Electron attachment to Cytosine: The Role of Water
Pooja Verma, Debashree Ghosh, Achintya Kumar Dutta
We present an EOM-CCSD based QM/MM study on the electron attachment process to cytosine, solvated in water. The microhydration studies cannot capture the effect of bulk water envir…
physics.chem-ph2020
A Core-Valence Separated Similarity Transformed EOM-CCSD Method for Core-excitation Spectra
Santosh Ranga, Achintya Kumar Dutta
We present the theory and implementation of a core-valence separated similarity transformed EOM-CCSD (STEOM-CCSD) method for K-edge core excitation spectra. The method can select a…