Efficient implementation of effective core potential...

The Journal of Chemical Physics 2015 / 07 Vol. 143; Iss. 1

Efficient implementation of effective core potential integrals and gradients on graphical processing units

Song, Chenchen, Wang, Lee-Ping, Sachse, Torsten, Preiß, Julia, Presselt, Martin, Martínez, Todd J.
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Volume:
143
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.4922844
Date:
July, 2015
File:
PDF, 2.40 MB
english, 2015
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