Incidence of the muffin-tin approximation on the electronic structure of large clusters calculated by theMS-LSD method: The typical case of C60-Reference-Cited by-同舟云学术

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Incidence of the muffin-tin approximation on the electronic structure of large clusters calculated by theMS-LSD method: The typical case of C60

Published:1994-08-15 Issue:5 Volume:51 Page:319-328
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Razafinjanahary H.,Rogemond F.,Chermette H.

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference35 articles.

1. Electronic structure of ferrocyanide ion calculated by the SCF Xα-scattered wave generalized partitioning method

2. A plain man's view of the muffin-tin approximation in molecular calculations, and the solid state

3. Binuclear electron reservoir complexes. Synthesis, stabilization and electronic structures of the 36- and 37-electron complexes [[Fe(C5R5)]2(.mu.2,.eta.n-C10H8)]m+ (R = H, Me): from biphenyl (m = 1 and 2, n = 12) to bicyclohexadienylidene (m = 0, n = 10)

4. Potential energy surfaces and the multiple scattering (MS) Xα method: A new study of the cases H2O and NH3

Cited by 2 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Self-interaction error in density functional theory: a mean-field correction for molecules and large systems;Chemical Physics;2005-02

2. Multiplet structures of charged fullerenes;Journal of Physics B: Atomic, Molecular and Optical Physics;2004-06-12

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