Search Results - "RT parallel algorithm"

A novel parallel algorithm for large-scale Fock matrix construction with small locally distributed memory architectures: RT parallel algorithm by Takashima, Hajime, Yamada, So, Obara, Shigeru, Kitamura, Kunihiro, Inabata, Shinjiro, Miyakawa, Nobuaki, Tanabe, Kazutoshi, Nagashima, Umpei

“… it the “RT parallel algorithm.” The RT parallel algorithm actively involves the concept of integral screening, which is indispensable for reduction of computing times with large…”
Get full text

Rapid computation of all sets of electron-repulsion integrals for large-scale molecules by Takashima, Hajime, Kitamura, Kunihiro

“… Combination of the RT parallel algorithm with the nonredundant method demonstrated performance faster than the G amess program by a margin greater than fivefold even with a single processor…”
Get full text