Optimizing Tensor Contractions in CCSD(T) for Efficient Execution on GPUs

Author:

Kim Jinsung1,Sukumaran-Rajam Aravind1,Hong Changwan1,Panyala Ajay2,Srivastava Rohit Kumar1,Krishnamoorthy Sriram2,Sadayappan P.1

Affiliation:

1. The Ohio State University

2. Pacific Northwest National Laboratory

Funder

National Nuclear Security Administration

National Science Foundation

U.S. Department of Energy

Publisher

ACM

Reference36 articles.

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3. Liquid water

4. Efficient Implementation of Many-Body Quantum Chemical Methods on the Intel® Xeon Phi Coprocessor

5. K. Kowalski S. Krishnamoorthy R. M. Olson V. Tipparaju and E. Aprà "Scalable implementations of accurate excited-state coupled cluster theories: application of high-level methods to porphyrin-based systems " in Conference on High Performance Computing Networking Storage and Analysis SC 2011 Seattle WA USA November 12-18 2011 2011 pp. 72:1--72:10. 10.1145/2063384.2063481 K. Kowalski S. Krishnamoorthy R. M. Olson V. Tipparaju and E. Aprà "Scalable implementations of accurate excited-state coupled cluster theories: application of high-level methods to porphyrin-based systems " in Conference on High Performance Computing Networking Storage and Analysis SC 2011 Seattle WA USA November 12-18 2011 2011 pp. 72:1--72:10. 10.1145/2063384.2063481

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