Publications per year
Publications per year
Overview
Education/Academic qualification
Comp-Comp Sci, Doctorate Degree
Fingerprint
Dive into the research topics where Kshitij Mehta is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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Researcher collaborations from the last five years
Based on publications and projects (not datasets). Dive into details by clicking on the dots or
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Scalable training of trustworthy and energy-efficient predictive graph foundation models for atomistic materials modeling: a case study with HydraGNN
Lupo Pasini, M., Choi, J. Y., Mehta, K., Zhang, P., Rogers, D., Bae, J., Ibrahim, K. Z., Aji, A. M., Schulz, K. W., Polo, J. & Balaprakash, P., Mar 2025, In: Journal of Supercomputing. 81, 4, 618.Research output: Contribution to journal › Article › peer-review
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Automated Calibration of a Simulator of MPI Application Executions
Wong, Y. C., Suter, F., Mehta, K., Casanova, H. & Mcdonald, J., 2024, Proceedings - 2024 IEEE 20th International Conference on e-Science, e-Science 2024. Institute of Electrical and Electronics Engineers Inc., (Proceedings - 2024 IEEE 20th International Conference on e-Science, e-Science 2024).Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review
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MDLoader: A Hybrid Model-Driven Data Loader for Distributed Graph Neural Network Training
Bae, J., Choi, J. Y., Pasini, M. L., Mehta, K., Zhang, P. & Ibrahim, K. Z., 2024, Proceedings of SC 2024-W: Workshops of the International Conference for High Performance Computing, Networking, Storage and Analysis. Institute of Electrical and Electronics Engineers Inc., p. 1046-1057 12 p. (Proceedings of SC 2024-W: Workshops of the International Conference for High Performance Computing, Networking, Storage and Analysis).Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review
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MDLoader: A Hybrid Model-driven Data Loader for Distributed Deep Neural Networks Training
Bae, J., Choi, J. Y., Pasini, M. L., Mehta, K. & Ibrahim, K. Z., 2024, 2024 IEEE International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2024. Institute of Electrical and Electronics Engineers Inc., p. 1193-1195 3 p. (2024 IEEE International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2024).Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review
Open Access -
Scaling Ensembles of Data-Intensive Quantum Chemical Calculations for Millions of Molecules
Mehta, K., Pasini, M. L., Irle, S., Yoo, P., Suter, F., Ganyushin, D. & Klasky, S., 2024, 2024 IEEE International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2024. Institute of Electrical and Electronics Engineers Inc., p. 1047-1056 10 p. (2024 IEEE International Parallel and Distributed Processing Symposium Workshops, IPDPSW 2024).Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review
Open Access1 Scopus citations
Datasets
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ORNL_AISD-Ex: Quantum chemical prediction of UV/Vis absorption spectra for over 10 million organic molecules
Lupo Pasini, M. (Creator), Mehta, K. (Creator), Yoo, P. (Creator) & Irle, S. (Creator), Constellation by Oak Ridge Leadership Computing Facility (OLCF), Jan 12 2023
Dataset
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GDB-9-Ex: Quantum chemical prediction of UV/Vis absorption spectra for GDB-9 molecules
Lupo Pasini, M. (Creator), Yoo, P. (Creator), Mehta, K. (Creator) & Irle, S. (Creator), Constellation by Oak Ridge Leadership Computing Facility (OLCF), Nov 22 2022
Dataset
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HydraGNN_Predictive_GFM_2024 - Ensemble of predictive graph foundation models for ground state atomistic materials modeling
Lupo Pasini, M. (Creator), Choi, J. Y. (Creator), Mehta, K. (Creator), Zhang, P. (Creator), Rogers, D. (Creator), Bae, J. (Creator), Ibrahim, K. (Creator), Aji, A. (Creator), Schulz, K. W. (Creator), Polo, J. (Creator) & Balaprakash, P. (Creator), Constellation by Oak Ridge Leadership Computing Facility (OLCF), Nov 1 2024
Dataset