Extended slater basis sets for the transition metals scandium through zinc

1988 ◽  
Vol 92 (16) ◽  
pp. 4588-4590 ◽  
Author(s):  
Lillian M. Hansen ◽  
Dennis S. Marynick
Keyword(s):  
Transition Metals ◽  
Basis Sets ◽  
Slater Basis

On a Perturbed Hartree‐Fock Study of the Magnetic Susceptibility and the 13C and 17O NMR Shielding Constants in Formaldehyde with Slater Basis Sets

1972 ◽  
Vol 57 (1) ◽  
pp. 20-28 ◽  
Author(s):  
Tadashi Tokuhiro ◽  
Bernard R. Appleman ◽  
Gideon Fraenkel ◽  
P. K. Pearson ◽  
C. W. Kern
Keyword(s):  
Magnetic Susceptibility ◽  
Basis Sets ◽  
17O Nmr ◽  
Hartree Fock ◽  
Shielding Constants ◽  
Slater Basis

scholarly journals DFT Optimized All-Electron Basis Sets for Gradient Corrected Functionals: 4d Transition Metals

2007 ◽  
Vol 3 (2) ◽  
pp. 201-213 ◽  
Author(s):  
Patrizia Calaminici ◽  
Roberto Mejia-Olvera
Keyword(s):  
Transition Metals ◽  
Basis Sets

Atomic natural orbital basis sets for transition metals

1993 ◽  
Vol 86 (1-2) ◽  
pp. 13-24 ◽  
Author(s):  
Charles W. Bauschlicher ◽  
Peter R. Taylor
Keyword(s):  
Transition Metals ◽  
Basis Sets ◽  
Natural Orbital ◽  
Orbital Basis ◽  
Atomic Natural Orbital

Density-functional generalized-gradient and hybrid calculations of electromagnetic properties using Slater basis sets

2004 ◽  
Vol 120 (16) ◽  
pp. 7252-7261 ◽  
Author(s):  
Mark A. Watson ◽  
Nicholas C. Handy ◽  
Aron J. Cohen ◽  
Trygve Helgaker
Keyword(s):  
Density Functional ◽  
Basis Sets ◽  
Electromagnetic Properties ◽  
Generalized Gradient ◽  
Slater Basis
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