𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Ab initio model potential embedded cluster study of the structure and spectroscopy of V3+-doped elpasolites K2NaScF6, Cs2NaYCl6 and Cs2NaYBr6

✍ Scribed by Abdalla Al-Abdalla; Luis Seijo; Zoila Barandiarán

Book ID
114143080
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
115 KB
Volume
451
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Structure and spectroscopy of Cr3+ defec
Structure and spectroscopy of Cr3+ defects in KMgF3, KZnF3, and CsCaF3 crystals. An ab initio model potential embedded cluster study
✍ Sara López-Moraza; Luis Seijo; Zoila Barandiarán 📂 Article 📅 2000 🏛 John Wiley and Sons 🌐 English ⚖ 216 KB 👁 2 views

The ab initio model potential (AIMP) method has been proven to produce effective one-electron operators that accurately represent the embedding effects of the cations and anions that consititute crystalline lattices like the KMgF 3 , KZnF 3 , and CsCaF 3 cubic fluoroperovskites. The combination of t

Syntheses and Crystal Structures of the
Syntheses and Crystal Structures of the Cluster Compounds A2[(W6Br3.0.CO;2-A/asset/equation/tex2gif-stack-1.gif?v=1&t=h5l3kt35&s=e74f1fc8be6246e083fc5deafc2f462f0248ae3a" class="inlineGraphic">)Br3.0.CO;2-A/asset/equation/tex2gif-stack-2.gif?v=1&t=h5l3kt35&s=76c2e86c2a8b850da7b366a5b8924d3b962ef395" class="inlineGraphic">] with A = K, Rb, Cs
✍ Yue-Qing Zheng; Karl Peters; Yuri Grin; Hans Georg von Schnering 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 German ⚖ 254 KB 👁 2 views

K 2 W 6 Br 14 (I), Rb 2 W 6 Br 14 (II), and Cs 2 W 6 Br 14 (III) were formed by reactions of W 6 Br 12 with the corresponding alkali metal bromides in evacuated silica tubes with a temperature gradient of 925 K/915 K. (I) crystallizes in the cubic space group Pn3 (no. 201), a = 13.808 A Ê , Z = 4, c