Electron Affinities, Ionization Energies, and Fragmentation Energies of Fen Clusters (n = 2−6): A Density Functional Theory Study
- 14 August 2003
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry A
- Vol. 107 (36) , 7013-7023
- https://doi.org/10.1021/jp030288p
Abstract
No abstract availableThis publication has 70 references indexed in Scilit:
- Chemical Bonding, Electron Affinity, and Ionization Energies of the Homonuclear 3d Metal DimersThe Journal of Physical Chemistry A, 2003
- Can all of the Fe2experimental results be explained?Molecular Physics, 2003
- REACTIONS ANDTHERMOCHEMISTRY OFSMALLTRANSITIONMETALCLUSTERIONSAnnual Review of Physical Chemistry, 2001
- On the integration accuracy in molecular density functional theory calculations using Gaussian basis setsComputer Physics Communications, 2001
- Fully Unconstrained Approach to Noncollinear Magnetism: Application to Small Fe ClustersPhysical Review Letters, 1998
- Photoelectron spectroscopy of size-selected transition metal clusters: Fe−n, n=3–24The Journal of Chemical Physics, 1995
- Density-functional calculations for small iron clusters: , , and for n≤5Physical Review B, 1994
- Photoionization studies of transition metal clusters: Ionization potentials for Fen and ConThe Journal of Chemical Physics, 1990
- Chemical probes of metal cluster ionization potentialsThe Journal of Chemical Physics, 1990
- A study of the low-lying electronic states of Fe2 and Co2 by negative ion photoelectron spectroscopyThe Journal of Chemical Physics, 1986