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Automated Operation Minimization of Tensor Contraction Expressions in Electronic Structure Calculations.

A. Hartono, A. Sibiryakov, M. Nooijen, G. Baumgartner, D. Bernholdt, S. Hirata, C. Lam, R. Pitzer, J. Ramanujam, and P. Sadayappan. International Conference on Computational Science (1), volume 3514 of Lecture Notes in Computer Science, page 155-164. Springer, (2005)

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Russell Ngo University of Stuttgart

Russell Kajouri University of Stuttgart

M. Nudischer

M. Kratzer

M. Liewald

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A high-level approach to synthesis of high-performance codes for quantum chemistry.G. Baumgartner, D. Bernholdt, D. Cociorva, R. Harrison, S. Hirata, C. Lam, M. Nooijen, R. Pitzer, J. Ramanujam, and P. Sadayappan. SC, page 33:1-33:10. IEEE Computer Society, (2002)Identifying Cost-Effective Common Subexpressions to Reduce Operation Count in Tensor Contraction Evaluations.A. Hartono, Q. Lu, X. Gao, S. Krishnamoorthy, M. Nooijen, G. Baumgartner, D. Bernholdt, V. Choppella, R. Pitzer, J. Ramanujam and 2 other author(s). International Conference on Computational Science (1), volume 3991 of Lecture Notes in Computer Science, page 267-275. Springer, (2006)Atomic self-consistent-field program by the basis set expansion method: Columbus version.R. Pitzer. Comput. Phys. Commun., 183 (8): 1841-1842 (2012)Automated Operation Minimization of Tensor Contraction Expressions in Electronic Structure Calculations.A. Hartono, A. Sibiryakov, M. Nooijen, G. Baumgartner, D. Bernholdt, S. Hirata, C. Lam, R. Pitzer, J. Ramanujam, and P. Sadayappan. International Conference on Computational Science (1), volume 3514 of Lecture Notes in Computer Science, page 155-164. Springer, (2005)Atomic self-consistent-field program by the basis set expansion method: Columbus version.R. Pitzer. Comput. Phys. Commun., 170 (3): 239-264 (2005)