Structural identification of silicene on the Ag(111) surface by atomic force microscopy

masahiro.fukuda / root13_silicene_on_Ag111

更新: 2023-05-26

概要

We identified structures of two types of buckled structure of ($\sqrt{13} \times \sqrt{13}$) R13.9$^\circ$ silicene on Ag(111) by using experimental high-resolution AFM imaging. The mechanism of high-resolution AFM imaging was elucidated by force spectroscopy combined with first-principles calculations. This database provides the input files and the results of the DFT calculations by OpenMX.

URL: https://isspns-gitlab.issp.u-tokyo.ac.jp/masahiro.fukuda/root13_silicene_on_Ag111
DOI: 10.1103/PhysRevB.98.195311
被引用数: 19 件（OpenAlex、2026-10-05 時点）
著者: Lingyu Feng, Keisuke Yabuoshi, Yoshiaki Sugimoto, Jo Onoda, Masahiro Fukuda, Taisuke Ozaki
ライセンス: CC BY 4.0
キーワード: siliceneAg(111)two-dimensional materialsbuckled honeycomb latticestructural identificationforce spectroscopy（論文のキーワード、OpenAlex より）
カテゴリ: 電子状態計算（固体物理）
関連文献: Phys. Rev. B 98, 195311 (2018)
関連ソフトウェア: OpenMX (リンク先: PASUMS ソフトウェアカタログ)
連絡先: masahiro.fukuda__at__issp.u-tokyo.ac.jp (__at__ を @ に置き換えてください。)

論文と引用

このデータを利用した場合は、次の論文を引用してください。

Lingyu Feng et al., "Structural identification of silicene on the Ag(111) surface by atomic force microscopy", Physical review. B./Physical review. B 98(19) (2018). https://doi.org/10.1103/PhysRevB.98.195311

BibTeX を表示

@article{Feng_2018, title={Structural identification of silicene on the Ag(111) surface by atomic force microscopy}, volume={98}, ISSN={2469-9969}, url={http://dx.doi.org/10.1103/physrevb.98.195311}, DOI={10.1103/physrevb.98.195311}, number={19}, journal={Physical Review B}, publisher={American Physical Society (APS)}, author={Feng, Lingyu and Yabuoshi, Keisuke and Sugimoto, Yoshiaki and Onoda, Jo and Fukuda, Masahiro and Ozaki, Taisuke}, year={2018}, month=Nov }

書誌情報とオープンアクセスのリンクは OpenAlex、BibTeX は doi.org（出版社が登録した情報）から取得しています。

リンク

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README

Structural identification of silicene on the Ag(111) surface by atomic force microscopy

About

We identified structures of two types of buckled structure of ($\sqrt{13} \times \sqrt{13}$) R13.9$^\circ$ silicene on Ag(111) by using experimental high-resolution AFM imaging. The mechanism of high-resolution AFM imaging was elucidated by force spectroscopy combined with first-principles calculations. This database provides the input files and the results of the DFT calculations by OpenMX.

License, Copyright of the database

CC BY 4.0 We hope that you cite the reference when you publish the results using our data:
Phys. Rev. B 98, 195311 (2018)

Usage

Install Database

Using git

git clone https://isspns-gitlab.issp.u-tokyo.ac.jp/masahiro.fukuda/root13_silicene_on_Ag111.git

On browser Click the download button of this project.

Data info
- data/surface/Ag:
  - The substrate is generated from primitive Ag.
- data/surface/root13_Silicene_on_Ag
  - The input files and geometrical optimization results of the type A and type B of ($\sqrt{13} \times \sqrt{13}$) R13.9$^\circ$ silicene on Ag(111) and Ag(-1-1-1)
- data/surface/root13_Silicene_on_Ag_2by2
  - $2 \times 2$ supercell results of the above
- data/afm/root13_Silicene_on_Ag_2by2_tip001
  - The input files and geometrical optimization results of the type A and type B of ($\sqrt{13} \times \sqrt{13}$) R13.9$^\circ$ silicene on Ag(-1-1-1) with Si tip001 above a specific Si atom using a $2 \times 2$ supercell.
- data/afm/root13_Silicene_on_Ag_tip111
  - The input files and geometrical optimization results of the type A and type B of ($\sqrt{13} \times \sqrt{13}$) R13.9$^\circ$ silicene on Ag(-1-1-1) with Si tip111 above a specific Si atom.

data
|---- afm
|   |---- data_in_fig5
|   |   |---- typeA
|   |   |---- typeB
|   |---- root13_Silicene_on_Ag_2by2_tip001
|   |   |---- TypeA_m1m1m1
|   |   |   |---- atom1
|   |   |   |---- atom4
|   |   |   |---- template
|   |   |---- TypeB_m1m1m1
|   |       |---- atom1
|   |       |---- atom4
|   |       |---- atom6
|   |       |---- template
|   |---- root13_Silicene_on_Ag_tip111
|       |---- TypeA_m1m1m1
|       |   |---- atom1
|       |   |---- atom12
|       |   |---- atom3
|       |   |---- atom4
|       |   |---- atom5
|       |   |---- template
|       |---- TypeB_111
|           |---- atom1
|           |---- atom12
|           |---- atom2
|           |---- atom3
|           |---- atom4
|           |---- atom5
|           |---- template
|---- surface
    |---- Ag
    |---- root13_Silicene_on_Ag
    |   |---- NEB_AB_111
    |   |---- TypeA_111
    |   |   |---- for_NEB
    |   |---- TypeA_m1m1m1
    |   |---- TypeB_111
    |   |---- TypeB_m1m1m1
    |---- root13_Silicene_on_Ag_2by2
        |---- TypeA_m1m1m1
        |---- TypeB_m1m1m1

Contact

Masahiro FUKUDA (ISSP, Univ. of Tokyo) masahiro.fukuda__at__issp.u-tokyo.ac.jp please replace __at__ by @.

出典: https://isspns-gitlab.issp.u-tokyo.ac.jp/masahiro.fukuda/root13_silicene_on_Ag111 の README

更新状況

更新最終更新: 2023-05-26 (3 年前)