4.7 Article

Approximated electron repulsion integrals: Cholesky decomposition versus resolution of the identity methods

Related references

Note: Only part of the references are listed.
Article Chemistry, Multidisciplinary

Theoretical investigation of clusters of phosphorus and arsenic: Fascination and temptation of high symmetries

Paola Nava et al.

CHEMISTRY-A EUROPEAN JOURNAL (2008)

Article Chemistry, Physical

Method specific Cholesky decomposition: Coulomb and exchange energies

Linus Boman et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Article Chemistry, Physical

Analytic derivatives for the Cholesky representation of the two-electron integrals

Francesco Aquilante et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Article Chemistry, Physical

Accurate ab initio density fitting for multiconfigurational self-consistent field methods

Francesco Aquilante et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Article Chemistry, Multidisciplinary

Hartree-Fock exchange fitting basis sets for H to Rn

Florian Weigend

JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)

Article Chemistry, Multidisciplinary

DFT modeling of silver disorder and mobility in the semiconductor cluster [Ag28S26(P(O)PhOMe)(12)(PPh3)(12)]

Nathan R. M. Crawford et al.

CHEMISTRY-A EUROPEAN JOURNAL (2008)

Article Chemistry, Physical

Unbiased auxiliary basis sets for accurate two-electron integral approximations

Francesco Aquilante et al.

JOURNAL OF CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

Accurate Coulomb-fitting basis sets for H to Rn

F Weigend

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2006)

Article Chemistry, Multidisciplinary

Al-Eu and Al-Yb donor-acceptor bonds

Michael T. Gamer et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2006)

Article Chemistry, Physical

Efficient evaluation of three-center two-electron integrals over Gaussian functions

R Ahlrichs

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2004)

Article Chemistry, Physical

Gaussian basis sets of quadruple zeta valence quality for atoms H-Kr

F Weigend et al.

JOURNAL OF CHEMICAL PHYSICS (2003)

Article Chemistry, Physical

Efficient use of the correlation consistent basis sets in resolution of the identity MP2 calculations

F Weigend et al.

JOURNAL OF CHEMICAL PHYSICS (2002)

Article Biochemistry & Molecular Biology

Molden: a pre- and post-processing program for molecular and electronic structures

G Schaftenaar et al.

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2000)