Quantum Chemistry on Graphical Processing Units. 1. Strategies for Two-Electron Integral Evaluation.

By Ivan S. Ufimtsev, Todd J. Martinez. Journal of Chemical Theory and Computation, 2008

684 citations recorded by the source corpus.

Subfields: Atomic and Molecular Physics, and Optics, Surfaces, Coatings and Films

View Paper: https://www.semanticscholar.org/paper/729e4d62e9d7c0e9c50d7ed750aea9374db18d9d

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Atomic and Molecular Physics, and Optics

1. F. García-Vidal
2. C. Climent
3. J. Feist
4. Javier Galego
5. Teemu Rantalaiho
6. Topi Siro
7. John R. Nickolls
8. Samuli Hakala

In Surfaces, Coatings and Films

1. F. García-Vidal
2. J. Feist
3. John R. Nickolls
4. C. Climent
5. Javier Galego
6. William (Bill) J. Dally

Citations in the corpus

• Computational Physics on Graphics Processing Units (2012, methodology): “They have used GPUs in ERIs [44,45,46], in complete SCF calculations [47] and in energy gradients [48].”
• The GPU Computing Era (2010, methodology): “Table 3 lists some representative applications along with the runtime speedups obtained for the whole application using CPUþGPU coprocessing over CPU alone, as measured by application developers.(12-22) The speedups using GeForce 8800, Tesla T8, GeForce GTX 280, Tesla T10, and GeForce GTX 285 range ”
• Cavity Casimir-Polder Forces and Their Effects in Ground-State Chemical Reactivity (2018, methodology): “All calculations are performed with the TeraChem package [102,103].”