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Fundamental and Computational Sciences Directorate

Staff information

Ponnuswamy Sadayappan

High-Performance Computing
Joint Appointment
Pacific Northwest National Laboratory
PO Box 999
MSIN:
Richland, WA 99352

PNNL Publications

2020

  • Apra E., E.J. Bylaska, W.A. De Jong, N. Govind, K. Kowalski, T.P. Straatsma, and M. Valiev, et al. 2020. "NWChem: Past, Present, and Future." The Journal of Chemical Physics 152, no. 18:184102. PNNL-SA-151542. doi:10.1063/5.0004997
  • Kim J., A.R. Panyala, B. Peng, K. Kowalski, P. Sadayappan, and S. Krishnamoorthy. 2020. "Scalable Heterogeneous Execution of a Coupled-Cluster Model with Perturbative Triples." In International Conference for High Performance Computing, Networking, Storage and Analysis (SC2020), November 9-19, 2020, Atlanta, GA, 1-15. Piscataway, New Jersey:IEEE. PNNL-SA-154438. doi:10.1109/SC41405.2020.00083

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