Fe(N₂)_n (n = 1−5): Structure, Bonding, and Vibrations from Density Functional Theory

This publication has 29 references indexed in Scilit:

• Reactions of Laser-Ablated Iron Atoms with Nitrogen Atoms and Molecules. Matrix Infrared Spectra and Density Functional Calculations of Novel Iron Nitride Molecules
  The Journal of Physical Chemistry, 1996
• Theoretical study of the monocarbonyls of first-row transition metal atoms
  The Journal of Chemical Physics, 1993
• Optimization of Gaussian-type basis sets for local spin density functional calculations. Part I. Boron through neon, optimization technique and validation
  Canadian Journal of Chemistry, 1992
• Side-on binding of the nitrogen molecule to first-row transition-metal dimers
  The Journal of Chemical Physics, 1991
• Thermal stability and kinetic lability of the metal carbonyl bond. A theoretical study on M(CO)6 (M = chromium, molybdenum, tungsten), M(CO)5 (M = iron, ruthenium, osmium), and M(CO)4 (M = nickel, palladium, platinum)
  Journal of the American Chemical Society, 1987
• Density-functional approximation for the correlation energy of the inhomogeneous electron gas
  Physical Review B, 1986
• Accurate and simple density functional for the electronic exchange energy: Generalized gradient approximation
  Physical Review B, 1986
• Theoretical aspects of the photochemistry of organometallics. 3. Potential energy curves for the photodissociation of pentacarbonyliron (Fe(CO)5)
  The Journal of Physical Chemistry, 1984
• Proposed iron–nitrogen molecule produced in a solid nitrogen matrix
  Journal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1977
• Magnetic circular dichroism evidence for the paramagnetism of tetracarbonyliron(0): low-temperature matrix studies
  Journal of the Chemical Society, Chemical Communications, 1977