Bonding within the Endohedral Fullerenes Sc₃N@C₇₈ and Sc₃N@C₈₀ as Determined by Density Functional Calculations and Reexamination of the Crystal Structure of {Sc₃N@C₇₈}·Co(OEP)}·1.5(C₆H₆)·0.3(CHCl₃)

This publication has 28 references indexed in Scilit:

• Roothaan-Hartree-Fock-Slater atomic wave functions: Single-zeta, double-zeta, and extended Slater-type basis sets for 87Fr-103Lr
  Published by Elsevier ,2004
• Theoretical study of endohedral metallofullerenes: Sc_3−nLa_nN@C₈₀ (n=0–3)
  Journal of Computational Chemistry, 2001
• Isolation and Crystallographic Characterization of ErSc₂N@C₈₀: an Endohedral Fullerene Which Crystallizes with Remarkable Internal Order
  Journal of the American Chemical Society, 2000
• A Density Functional Study of C₆₀ Transition Metal Complexes
  Organometallics, 2000
• Metal−Phosphorus Bonding in Fe(CO)₄PR₃ Complexes. A Density Functional Study
  Organometallics, 1997
• Electronic Structure and Thermodynamic Properties of ScC₂
  The Journal of Physical Chemistry A, 1997
• Uranium Stabilization of C ₂₈ : A Tetravalent Fullerene
  Science, 1992
• Lanthanum carbide (La2C80): a soluble dimetallofullerene
  The Journal of Physical Chemistry, 1991
• C60: Buckminsterfullerene
  Nature, 1985
• Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis
  Canadian Journal of Physics, 1980