Kinetics Database Logo

Kinetics Database Resources

Simple Reaction Search

Search Reaction Database

Search Bibliographic Database

Set Unit Preferences

Feedback

Rate Our Products and Services

Help


Other Databases

NIST Standard Reference Data Program

NIST Chemistry Web Book

NDRL-NIST Solution Kinetics Database

NIST Computational Chemistry Comparison and Benchmark Database

The NIST Reference on Constants, Units, and Uncertainty

More...


Administrative Links

NIST home page

MML home page

Chemical and Biochemical Reference Data Division

MML home page

Chemical and Biochemical Reference Data Division

  NIST Logo Home
©NIST, 2013
Accessibility information
Author(s):   Hannachi, Y.; Mascetti, J.; Stirling, A.; Papai, I.
Title:   Metal Insertion Route of the Ni + CO2 -> NiO + CO Reaction
Journal:   J. Phys. Chem. A
Volume:   107
Page(s):   6708 - 6713
Year:   2003
Reference type:   Journal article
Squib:   2003HAN/MAS6708-6713

Reaction:   CO2 + NiCO + NiO
Reaction order:   2
Rate expression:   no rate data available
Category:  Theory
Data type:   Ab initio
Comments:   The gas-phase reaction of the nickel atom with CO2 molecule is investigated at the B3LYP and CCSD(T) levels of theory.

View full bibliographic record.