𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Density functional-pseudopotential calculation of the heat of formation of disordered solid alkaline-earth alloys

✍ Scribed by D.J. González; J.A. Alonso


Publisher
Elsevier Science
Year
1982
Weight
448 KB
Volume
112
Category
Article
ISSN
0378-4363

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


The Heat of Formation of the Uranyl Dica
✍ Lyudmila V. Moskaleva; Alexei V. Matveev; Sven Krüger; Notker Rösch 📂 Article 📅 2006 🏛 John Wiley and Sons 🌐 English ⚖ 116 KB 👁 2 views

## Abstract By using a set of model reactions, we estimated the heat of formation of gaseous UO~2~^2+^ from quantum‐chemical reaction enthalpies and experimental heats of formation of reference species. For this purpose, we performed relativistic density functional calculations for the molecules UO