Golokesh Santra, Ph.D
Affiliations: | 2018-2023 | Molecular Chemistry and Materials Science | Weizmann Institute of Science, Rehovot, Israel |
| 2023- | Molecular Theory and Spectroscopy | Max Planck Institute for Coal Research, Mülheim an der Ruhr, Nordrhein-Westfalen, Germany |
Area:
Computational ChemistryGoogle:
"Golokesh Santra"Parents
Sign in to add mentor| Amalendu Chandra | research assistant | 2017-2018 | IIT Kanpur |
| Jan M.L. Martin | grad student | 2018-2023 | Weizmann Institute |
| Frank Neese | post-doc | 2023- | Max-Planck-Institut für Kohlenforschung |
| Dimitrios A. Pantazis | post-doc | 2023- | Max-Planck-Institut für Kohlenforschung |
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Publications
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| Santra G, Martin JML. (2022) Performance of Localized-Orbital Coupled-Cluster Approaches for the Conformational Energies of Longer -Alkane Chains. The Journal of Physical Chemistry. A. 126: 9375-9391 |
| Santra G, Semidalas E, Mehta N, et al. (2022) S66x8 noncovalent interactions revisited: new benchmark and performance of composite localized coupled-cluster methods. Physical Chemistry Chemical Physics : Pccp. 24: 25555-25570 |
| Santra G, Semidalas E, Martin JML. (2021) Surprisingly Good Performance of XYG3 Family Functionals Using a Scaled KS-MP3 Correlation. The Journal of Physical Chemistry Letters. 9368-9376 |
| Santra G, Semidalas E, Martin JML. (2021) Exploring Avenues beyond Revised DSD Functionals: II. Random-Phase Approximation and Scaled MP3 Corrections. The Journal of Physical Chemistry. A. 125: 4628-4638 |
| Woller T, Banerjee A, Sylvetsky N, et al. (2020) Performance of Electronic Structure Methods for the Description of Hückel-Möbius Interconversions in Extended π-Systems. The Journal of Physical Chemistry. A |