Atomic Cholesky decompositions: A route to unbiased auxiliary basis sets for density fitting approximation with tunable accuracy and efficiency
Aquilante, Francesco, Gagliardi, Laura, Pedersen, Thomas Bondo, Lindh, RolandТом:
130
Рік:
2009
Мова:
english
Журнал:
The Journal of Chemical Physics
DOI:
10.1063/1.3116784
Файл:
PDF, 975 KB
english, 2009