An improved 6-31G* basis set for first-row transition metals
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1563619
Reference40 articles.
1. Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic Molecules
2. Self‐consistent molecular orbital methods. XV. Extended Gaussian‐type basis sets for lithium, beryllium, and boron
3. Self‐consistent molecular orbital methods. XIX. Split‐valence Gaussian‐type basis sets for beryllium
4. Self‐consistent molecular orbital methods. XXIII. A polarization‐type basis set for second‐row elements
5. The influence of polarization functions on molecular orbital hydrogenation energies
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