𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Computation of the total energy of transition metals by a model electron density function

✍ Scribed by Yu. A. Khon; V. M. Kuznetsov; V. Ya. Dvoretskii; V. P. Fadin


Book ID
112426747
Publisher
Springer
Year
1981
Tongue
English
Weight
340 KB
Volume
24
Category
Article
ISSN
1573-9228

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Electron affinities of metals computed b
✍ Branko S. Jursic πŸ“‚ Article πŸ“… 1997 πŸ› John Wiley and Sons 🌐 English βš– 137 KB πŸ‘ 2 views

An extensive computational study of the meal electron affinity was performed using the Ε½ . ab initio and density functional theory DFT methods. HF, MP2, MP3, MP4, QCISD, and Ε½ . QCISD T was used as computational methods, while the hybrid, local, and nonlocal DFT methods with the LYP, P86, PW91, and