Small nickel clusters up to the tetramer are investigated within the framework of the local spin density functional theory. Several competitive states are studied for the dimer. Both the geometry and the spin state are optimized for several starting symmetries in the case of the trimer and the tetra
✦ LIBER ✦
Density Functional Study of Structural and Electronic Properties of Small Bimetallic Silver—Nickel Clusters
✍ Scribed by M. Harb; F. Rabilloud; D. Simon
- Publisher
- John Wiley and Sons
- Year
- 2007
- Weight
- 14 KB
- Volume
- 38
- Category
- Article
- ISSN
- 0931-7597
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
A density functional study of small nick
✍
M. C. Michelini; R. Pis Diez; A. H. Jubert
📂
Article
📅
1998
🏛
John Wiley and Sons
🌐
English
⚖ 304 KB
👁 2 views
Density functional study of small molybd
✍
Reinaldo Pis Diez
📂
Article
📅
2000
🏛
John Wiley and Sons
🌐
English
⚖ 178 KB
👁 2 views
Small molybdenum clusters up to the tetramer are investigated within the framework of the density functional theory. Both the geometry and the spin state are optimized for the dimer, trimer, and the tetramer. Moreover, all those calculations are followed by a vibrational analysis to discriminate bet
Density Functional Study of Small Neutra
✍
Shuang Zhao; Zhi-Pan Liu; Zhen-Hua Li; Wen-Ning Wang; Kang-Nian Fan
📂
Article
📅
2006
🏛
John Wiley and Sons
⚖ 8 KB
👁 2 views
Structural, Electronic, and Magnetic Pro
✍
Houqian Sun; You-Hua Luo; Jijun Zhao; Guanghou Wang
📂
Article
📅
1999
🏛
John Wiley and Sons
🌐
English
⚖ 210 KB
👁 2 views
Geometrical and Electronic Structure of
✍
Wei Quan Tian; Maofa Ge; B. R. Sahu; Dianxun Wang; Toshiki Yamada; Shinro Mashik
📂
Article
📅
2004
🏛
John Wiley and Sons
⚖ 52 KB
👁 1 views
Density Functional Theory Study of Geome
✍
Dongju Zhang; Guanlun Guo; Chengbu Liu; R. Q. Zhang
📂
Article
📅
2007
🏛
John Wiley and Sons
⚖ 11 KB
👁 2 views