Assessment of density functional theory methods for the computation of heats of formation and ionization potentials of systems containing third row transition metals.
Riley, Kevin E
Assessment of density functional theory methods for the computation of heats of formation and ionization potentials of systems containing third row transition metals. [electronic resource] - The journal of physical chemistry. A Jul 2007 - 6044-53 p. digital
Publication Type: Journal Article; Research Support, N.I.H., Extramural
1089-5639
10.1021/jp0705931 doi
Hot Temperature
Ions--chemistry
Models, Chemical
Quantum Theory
Thermodynamics
Transition Elements--chemistry
Assessment of density functional theory methods for the computation of heats of formation and ionization potentials of systems containing third row transition metals. [electronic resource] - The journal of physical chemistry. A Jul 2007 - 6044-53 p. digital
Publication Type: Journal Article; Research Support, N.I.H., Extramural
1089-5639
10.1021/jp0705931 doi
Hot Temperature
Ions--chemistry
Models, Chemical
Quantum Theory
Thermodynamics
Transition Elements--chemistry