Concepedia
Statistics
Publications
5
Citations
169
H-Index
Active since
2019
Affiliations
University of Groningen(Current)
Universitat Rovira i Virgili
Institució Catalana de Recerca i Estudis Avançats
Oak Ridge National Laboratory
Ghent University
R. K. Kathir is an author at University of Groningen specializing in natural sciences, ab initio methods, and chemistry.
Publications per year
2019–2022
Singlet Fission Rate: Optimized Packing of a Molecular Pair. Ethylene as a Model
Alexandr Zaykov, P. Felkel, Eric A. Buchanan et al. · Journal of the American Chemical Society · 2019 · 51 citations · Full text
Natural Sciences, Chemistry, Computational Chemistry +16
Reduced Common Molecular Orbital Basis for Nonorthogonal Configuration Interaction
R. K. Kathir, Coen de Graaf, Ria Broer et al. · Journal of Chemical Theory and Computation · 2020 · 45 citations · Full text
Natural Sciences, Chemistry, Physics +17
GronOR: Massively parallel and GPU-accelerated non-orthogonal configuration interaction for large molecular systems
Tjerk P. Straatsma, Ria Broer, Shirin Faraji et al. · The Journal of Chemical Physics · 2020 · 31 citations · Full text
Pre-exascale accelerated application development: The ORNL Summit experience
Lei Luo, Tjerk P. Straatsma, Luis Enrique Aguilar Suarez et al. · IBM Journal of Research and Development · 2020 · 23 citations · Full text
Computing, Computer Science, High-performance Computing +17
On the role of dynamic electron correlation in non-orthogonal configuration interaction with fragments
Aitor Sánchez-Mansilla, Carmen Sousa, R. K. Kathir et al. · Physical Chemistry Chemical Physics · 2022 · 19 citations · Full text
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