Keywords
Basis (linear algebra)PolarizabilityBasis setSTO-nG basis setsWave functionAtomic physicsMolecular orbitalIonizationSymmetry (geometry)Matrix (chemical analysis)ChemistryIonPhysicsComputational chemistryQuantum mechanicsMathematicsMoleculeDensity functional theoryComplete active spaceGeometry
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Publication Info
- Year
- 1991
- Type
- article
- Volume
- 79
- Issue
- 6
- Pages
- 419-432
- Citations
- 731
- Access
- Closed
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Cite This
Per‐Olof Widmark,
B. Joakim Persson,
Bj�rn O. Roos
(1991).
Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions.
Theoretical Chemistry Accounts
, 79
(6)
, 419-432.
https://doi.org/10.1007/bf01112569
Identifiers
- DOI
- 10.1007/bf01112569