...
  • 主题
高级搜索  >
历史搜索 清空历史
首页> 外文期刊>The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory >Formation of self-assembled chains of tetrathiafulvalene on a Cu(100) surface
【24h】

Formation of self-assembled chains of tetrathiafulvalene on a Cu(100) surface

机译：Cu（100）表面上四硫富瓦烯自组装链的形成

获取原文
获取原文并翻译 | 示例
           
页面导航
  • 摘要
  • 著录项
  • 相似文献
  • 相关主题

摘要

Formation of self-assembled chains of tetrathiafulvalene (TTF) on the Cu(100) surface has been investigated by scanning tunneling microscopy and density functional theory calculations that include semiempirical van der Waals (vdW) interaction corrections. The calculations show that the chain structures observed in the experiments can only be explained by including the vdW interactions. The molecules are tilted along the chain in order to achieve maximal intermolecular interaction. The chains are metastable on the surface, which is consistent with the experimental observation that they disappear after annealing. The fact that all TTF chains observed in the experiment are short might be possibly explained by the interplay between the stabilizing vdW molecule-molecule interaction and the destabilizing rearrangement of surface atoms due to the strong molecule-substrate interaction.
机译：已经通过扫描隧道显微镜和包括半经验范德华（vdW）相互作用校正的密度泛函理论计算研究了Cu（100）表面上四硫富瓦烯（TTF）自组装链的形成。计算表明，在实验中观察到的链结构只能通过包括vdW相互作用来解释。分子沿链倾斜，以实现最大的分子间相互作用。链在表面上是亚稳态的，这与退火后消失的实验观察结果一致。实验中观察到的所有TTF链都很短的事实可能是由于稳定的vdW分子-分子相互作用与由于强烈的分子-底物相互作用导致表面原子的不稳定重排之间的相互作用所致。

著录项

相似文献

  • 外文文献
  • 中文文献
  • 专利
获取原文

客服邮箱：kefu@zhangqiaokeyan.com

京公网安备：11010802029741号 ICP备案号：京ICP备15016152号-6 六维联合信息科技 (北京) 有限公司©版权所有

  • 客服微信

  • 服务号