Ab initio Hartree–Fock and configuration‐interaction treatment of the interaction between two nickel atoms
- 1 March 1979
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 15 (3) , 311-331
- https://doi.org/10.1002/qua.560150306
Abstract
No abstract availableKeywords
This publication has 33 references indexed in Scilit:
- Modeling catalytic reactions with transition metal atoms. 1. Synthesis and characterization of reactive intermediates in the nickel-ethylene system, (C2H4)nNi (where n = 1, 2, or 3) in low temperature matricesJournal of the American Chemical Society, 1976
- Structures, binding energies, and charge distributions for two to six atom Ti, Cr, Fe, and Ni clusters and their relationship to nucleation and cluster catalysisThe Journal of Chemical Physics, 1976
- Molecular-orbital studies of transition- and noble-metal clusters by the self-consistent-field-scattered-wave methodPhysical Review B, 1976
- The visible absorption spectra of Mn2, Fe2, and Ni2 in argon matricesChemical Physics Letters, 1975
- Bonding of Ethylene to Diatomic Nickel according to a Self-Consistent-Field,, Scattered-Wave ModelPhysical Review Letters, 1974
- Calculation of the electronic structure of ethylene bonded to diatomic nickel and correlation with Ni-C2H2photo–emission dataFaraday Discussions of the Chemical Society, 1974
- Molecular orbital theory of the diatomic molecules of the first row transition metalsThe Journal of Physical Chemistry, 1972
- Ground States, Configurations, and Truncated Orbital Bases of the Iron-Series AtomsThe Journal of Chemical Physics, 1968
- Heisenberg Exchange Interaction of Two Mn AtomsPhysical Review B, 1964
- Self-Consistent Field Theory for Open Shells of Electronic SystemsReviews of Modern Physics, 1960