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