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Kristopher Keipert

Observed names: Keipert, K, Keipert, Kristopher
ORCID: 0000-0003-1476-8582
Observed ORCID: 0000-0003-1476-8582
OpenAlex ID: A5083201191
Dynamics Simulations with Spin-Flip Time-Dependent Density Functional Theory: Photoisomerization and Photocyclization Mechanisms of cis-Stilbene in ππ* States
2014 · Yu Harabuchi, Kristopher Keipert, et al. · The Journal of Physical Chemistry A · 98
From NWChem to NWChemEx: Evolving with the Computational Chemistry Landscape
2021 · Karol Kowalski, Raymond Bair, et al. · Chemical Reviews · 75
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Ab Initio Multiple Spawning Method for Intersystem Crossing Dynamics: Spin-Forbidden Transitions between 3B1 and 1A1 States of GeH2
2016 · Dmitry A. Fedorov, Spencer R. Pruitt, et al. · The Journal of Physical Chemistry A · 59
Harnessing the Power of Multi-GPU Acceleration into the Quantum Interaction Computational Kernel Program
2021 · Madushanka Manathunga, Chi Jin, et al. · Journal of Chemical Theory and Computation · 46
IMPECCABLE: Integrated Modeling PipelinE for COVID Cure by Assessing Better LEads
2021 · Saadi, AA, Alfe, D, et al. · UCL Discovery (University College London) · 29
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An efficient MPI/openMP parallelization of the Hartree-Fock method for the second generation of Intel ® Xeon Phi ™ processor
2017 · Vladimir Mironov, Yuri Alexeev, et al. · International Conference for High Performance Computing, Networking, Storage and Analysis (SC) · 27
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Energy-Efficient Computational Chemistry: Comparison of x86 and ARM Systems
2015 · Kristopher Keipert, Gaurav Mitra, et al. · Journal of Chemical Theory and Computation · 27
Performance Evaluation and Acceleration of the QTensor Quantum Circuit Simulator on GPUs
2021 · Danylo Lykov, Angela Chen, et al. · IEEE/ACM International Workshop on Quantum Computing Software (QCS) · 23
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Developing a Computational Chemistry Framework for the Exascale Era
2018 · Ryan M. Richard, Colleen Bertoni, et al. · Computing in Science & Engineering · 21
Performance and energy efficiency analysis of 64-bit ARM using GAMESS
2015 · Ananta Tiwari, Kristopher Keipert, et al. · 15
Nontotally symmetric trifurcation of an SN2 reaction pathway
2015 · Yu Harabuchi, Yuriko Ono, et al. · Journal of Computational Chemistry · 14
IMPECCABLE: Integrated Modeling PipelinE for COVID Cure by Assessing Better LEads
2021 · Aymen Al Saadi, Dario Alfe, et al. · Proceedings of the International Conference on Parallel Processing · 11
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PluginPlay: Enabling exascale scientific software one module at a time
2023 · Ryan M. Richard, Kristopher Keipert, et al. · The Journal of Chemical Physics · 8
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Excited state properties of 5-formylcytosine and 5-hydroxymethylcytosine
2017 · Joani Mato, Kristopher Keipert, et al. · Molecular Physics · 6
NWChemEx – Computational Chemistry for the Exascale Era
2020 · Hubertus van Dam, Edoardo Aprà, et al. · Bulletin of the American Physical Society · 4
Analyzing the Performance and Accuracy of Lossy Checkpointing on Sub-Iteration of NWChem
2019 · Tasmia Reza, Jon Calhoun, et al. · IEEE/ACM International Workshop on Data Analysis and Reduction for Big Scientific Data (DRBSD) · 4
Effect of frequency scaling granularity on energy-saving strategies
2018 · Vaibhav Sundriyal, Kristopher Keipert, et al. · The International Journal of High Performance Computing Applications · 4
Software Carpentry: The Unix Shell
2016 · Aldazabal Mensa, Inigo, Alexander, Harriet, et al. · Zenodo (CERN European Organization for Nuclear Research) · 4
Protein Generation via Genome-scale Language Models with Bio-physical Scoring
2023 · Gautham Dharuman, Logan Ward, et al. · International Conference for High Performance Computing, Networking, Storage and Analysis (SC) · 3
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IMPECCABLE: Integrated Modeling PipelinE for COVID Cure by Assessing Better LEads
2020 · Saadi, Aymen Al, Alfe, Dario, et al. · arXiv (Cornell University) · 2
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NWChemEx-Project/PluginPlay
2023 · Richard, Ryan, Keipert, Kristopher, et al. · OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)
PERMAVOST'22 Discussion Panel
2022 · Radita Liem, Connor Scully-Allison, et al.
PERMAVOST'22 Discussion Panel: Domain Scientists vs. Performance Analysis Tools: Advancing in HPC
2022 · Liem, Radita Tapaning Hesti, Scully-Allison, Connor, et al. · RWTH Publications (RWTH Aachen)
NWChemEx: Tackling Chemical, Materials, and Biochemical Challenges in the Exascale Era
2019 · Wibe A. de Jong, Kristopher Keipert, et al. · Bulletin of the American Physical Society
Knowledge is power: Quantum chemistry on novel computer architectures
2017 · Kristopher Keipert · Iowa State University Digital Repository (Iowa State University)
Works count: 29
Citation count: 484
H-index: 11
I10-index: 12
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