Probing the stability of the M2(Benzene)3 M聽=聽Fe, Co, and Ni structures upon electron attachment (deletion) and solvated iron clusters by benzene molecules: Fe2(Benzene)4
详细信息 查看全文
- 作者：Raul Flores ; Hector F. Cortes ; Miguel Castro ; miguel.castro.m@gmail.com" class="auth_mail" title="E-mail the corresponding author
- 关键词：Metal-ligand interactions ; Density functional theory ; Transition-metal-benzene complexes
- 刊名：Journal of Molecular Structure
- 出版年：2016
- 出版时间：5 January 2016
- 年：2016
- 卷：1103
- 期：Complete
- 页码：295-310
- 全文大小：3825 K
文摘
- class="listitem" id="list_ulist0010">
- class="label">•
Stability of the RB and MDS structures of [M2Benzene3]±1 M = Fe, Co, and Ni.
- class="label">•
Transition metal clusters solvated by benzene molecules: Fe2-(benzene)4.
- class="label">•
Use of density functional theory based methods for the study of metal–ligand systems.
- class="label">•
The importance of the C未−–H未+–蟺 interactions in the growth of Fe2-(Benzene)m clusters.