Appearance of V-encapsulated tetragonal prism motifs in VSi10− and VSi11− clusters

文献信息

发布日期 2020-09-21
DOI 10.1039/D0CP04101G
影响因子 3.676
作者

Li-Juan Zhang, Bin Yang, Da-Zhi Li


查看原文

摘要

The structural and electronic properties of V-doped silicon clusters, VSi10−/0 and VSi11−/0, were investigated by using mass-selected anion photoelectron spectroscopy in combination with theoretical calculations. Photoelectron spectroscopy of VSi10− and VSi11− clusters with spectral similarity reveals that the two cluster structures resemble each other. Interestingly, theoretical calculation studies provide definitive evidence of the global minima for the two clusters to be V-encapsulated tetragonal prism motifs with extra Si atoms bicapped and tricapped, respectively. The enhanced stability of the tetragonal prism unit in VSi10− and VSi11− is due to the strong interactions between 3d (V) and 3p (Si) orbitals, and more charge transfers from the Sin framework to the encapsulated V atom. The tetragonal prism unit possessed by both the VSi10− and VSi11− clusters is observed for the first time in the current work, and may offer new ideas in developing components for Si-based nanodevices.

相关文献

Front cover

Cover

DOI: 10.1039/C003852K

A molecular model for H2 interactions in aliphatic and aromatic hydrocarbons

Susana Figueroa-Gerstenmaier, Simona Giudice, Luigi Cavallo, Giuseppe Milano

2009-04-17 Paper

DOI: 10.1039/B900176J

Back cover

Front/Back Matter

DOI: 10.1039/C004145A

Astroelectrochemistry: the role of redox reactions in cosmic dust chemistry

Daren J. Caruana, Katherine B. Holt

2010-02-09 Perspective

DOI: 10.1039/B917817A

Structural investigation of Au(111)/butylthiolate adsorption phases

A. Chaudhuri, D. C. Jackson, T. J. Lerotholi, Robert G. Jones, T.-L. Lee, B. Detlefs, D. P. Woodruff

2010-02-23 Paper

DOI: 10.1039/B921281G

Revealing the base pair stepping dynamics of nucleic acidmotorproteins with optical traps

Yann R. Chemla

2010-02-19 Perspective

DOI: 10.1039/B920234J

From nanocrystal synthesis to functional nanostructure fabrication: laser ablation in liquid

P. Liu, H. Cui, C. X. Wang, G. W. Yang

2010-03-12 Perspective

DOI: 10.1039/B918759F

Front cover

Cover

DOI: 10.1039/B907298P

您可能还喜欢

化合物问答

如何处理含有顺-二(2,2'-联吡啶)二氯化钌(II)二水合物(CAS号:67776-38-9)的废料?

处理含有该化合物的废料时,应先收集并分类,然后根据其危险特性选择合适的处理方法。推荐采用焚烧或由专业机构进行安全处理,以确保符合环保法规的要求。处理过程中应佩戴...

67776-38-93-{[(2R,3R,4S,5R,6R)...
化合物问答

4-amino-2-bromo-3-iodopyridine(CAS号:1300750-77-9)的市场或研究趋势如何?

4-氨基-2-溴-3-碘吡啶主要应用于药物合成和研究领域,尤其是在抗病毒和抗癌药物的研发中。随着新型药物的需求增加,该化合物的研究趋势较好。市场方面,由于其特殊...

1300750-77-92-bromo-3-iodopyridi...
化合物问答

4-乙酰基氨基-2-氨基-苯甲酸(CAS号:43134-76-5)的市场或研究趋势如何?

当前,4-乙酰基氨基-2-氨基-苯甲酸(CAS号:43134-76-5)在医药和化工领域有一定的应用。随着药物研发的进展,该化合物在新型药物设计中的应用可能增加...

43134-76-54-Acetamido-2-aminob...
化合物问答

庚a氟-1-(1-碘-1,2,2,2-四氟乙氧基)丙烷(CAS号:107432-46-2)的市场或研究趋势如何?

该化合物目前主要用于特定的工业应用,如氟聚合物的合成。市场趋势显示,由于其独特的结构和性能,未来可能在新型氟材料和特种化学品领域有更多的应用。研究趋势方面,主要...

107432-46-21,1,1,2,2,3,3-Heptaf...
化合物问答

在合成中是否有Propargyl-PEG13-bromide(CAS号:2055105-25-2)的替代品?

可以考虑使用1,3-丁二烯-1-炔-3-基-聚乙二醇-13-溴化物作为Propargyl-PEG13-bromide的替代品,因为两者在结构上相似,均可用于合成...

2055105-25-2Propargyl-peg13-brom...
化合物问答

2-氨基-6-甲氧基嘌呤(CAS号:20535-83-5)安全吗?

2-氨基-6-甲氧基嘌呤在正常使用条件下相对安全,但在操作时仍需注意防护措施,如佩戴手套和护目镜,避免吸入或接触皮肤和眼睛。

20535-83-56-Methoxy-7H-purin-2...
化合物问答

2-甲基-3-溴苯乙酸乙酯(CAS号:1261862-72-9)适用哪些法规指南?

该化合物根据其化学性质和潜在危害,可能适用于GHS(全球化学品统一分类和标签制度)的分类标准。具体分类需依据其毒性和燃烧危险性进行评估。此外,欧洲化学品管理局(...

1261862-72-9Ethyl (3-bromo-2-met...
化合物问答

4,4-二甲基吡咯烷-3-羧酸盐酸盐(CAS号:1351343-41-3)应用于哪些行业?

4,4-二甲基吡咯烷-3-羧酸盐酸盐在医药、聚合物和传感器领域有应用。在医药领域,它可以作为某些药物的中间体;在聚合物领域,它可用作某些聚合物的稳定剂;在传感器...

1351343-41-34,4-Dimethyl-3-pyrro...
化合物问答

处理5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-6-yl 2-O-beta-D-xylopyranosyl-beta-D-glucopyranoside(CAS号:149998-39-0)时应注意哪些实验室安全事项?

处理该化合物时应注意使用个人防护装备(如手套、护目镜和实验服),在通风橱中操作。避免直接接触皮肤和吸入,泄漏时应立即清理并使用适当的吸收材料。参考安全数据表(S...

149998-39-05-Hydroxy-7-methoxy-...
化合物问答

7-甲基-1,2,3,4-四氢-吖啶-9-甲酸(CAS号:345621-27-4)的市场或研究趋势如何?

该化合物在医药研究中具有潜在应用价值,特别是在抗癌药物研发方面。随着研究的深入,对其合成方法的优化和生物活性的进一步探索将成为研究热点。

345621-27-47-Methyl-1,2,3,4-tet...

来源期刊

Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
自引率: 10.3%
年发文量: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

推荐供应商

免责声明
本页面提供的学术期刊信息仅供参考和研究使用。我们与任何期刊出版商均无关联,也不处理投稿事宜。如有投稿相关咨询,请直接联系相关期刊出版商。
如发现页面信息有误,请发送邮件至 support@chemtradehub.com 联系我们。我们将及时核实并处理您的问题。