On the expansion of molecular wavefunctions in a Gaussian basis set
Author:
Publisher
IOP Publishing
Subject
Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Link
http://stacks.iop.org/0953-4075/28/i=16/a=001/pdf
Reference52 articles.
1. The Dirac equation in the algebraic approximation. VI. Molecular self-consistent field studies using basis sets of Gaussian-type functions
2. Effective convergence to complete orbital bases and to the atomic Hartree–Fock limit through systematic sequences of Gaussian primitives
3. Systematic approach to extended even-tempered orbital bases for atomic and molecular calculations
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2. Distributed basis sets of s-type Gaussian functions for simple diatomics: Anharmonic-model distribution;International Journal of Quantum Chemistry;2007
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4. Distributed Gaussian basis sets: Variationally optimizeds-type sets for the open-shell systems HeH and BeH;International Journal of Quantum Chemistry;2004
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