Structure · dataset · 2019
On-surface synthesis of antiaromatic and open-shell indeno[2,1-b]fluorene polymers and their lateral fusion into porous ribbons
Listed in Materials Cloud Archive
This record contains the experimental and computational data needed to support the work done on on-surface synthesis of conjugated polymers consisting of indeno[2,1-b]fluorene units, which are antiaromatic and open-shell biradicaloids.
Description
The observed reaction products have been characterized via low-temperature scanning tunneling microscopy/spectroscopy and noncontact atomic force microscopy, complemented by density-functional theory calculations.
These polymers present a low band gap when adsorbed on Au(111). Moreover, their pronounced antiaromaticity and radical character, elucidated by ab initio calculations, make them promising candidates for applications in electronics and spintronics. Further, they provide a rich playground to explore magnetism in low-dimensional organic nanomaterials.
Links
Where it is published
- Materials Cloud Archive record archive.materialscloud.org/records/wh02e-ftt02 ↗
landing page · from archive materialscloud org
- DOI doi.org/10.24435/materialscloud:2019.0053/v1 ↗
DOI / persistent id · from archive materialscloud org
Catalogue records · 1
- InvenioRDM API archive.materialscloud.org/api/records/wh02e-ftt02 ↗
metadata API · from archive materialscloud org
Topics
- Stated by source
- antiaromatic · density functional theory · MARVEL/DD3 · NICS · on surface reactions · polymers
- From keywords
- Density functional theory · Materials Science
- Inferred from text
- Microscopy 75% · Organic semiconductors 75%
Provenance · 1 source records, 16 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| Materials Cloud Archive | wh02e-ftt02 | 2 d ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| access_level | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[field].anzsrc:field:401608 | enrichment · archive materialscloud org | taxonomy-embedding@1.1.0 | title+keywords+description (75%) |
| concepts[field].local:field:materials-science | mapping · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[method].local:method:dft | mapping · archive materialscloud org | vocabulary-mapper@1.0.0 | keywords['density functional theory'] |
| concepts[modality].local:modality:microscopy | enrichment · archive materialscloud org | keyword-concept-rules@1.0.0 | title+description (75%) |
| concepts[topic].invenio_subject:archive_materialscloud_org:antiaromatic | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[topic].invenio_subject:archive_materialscloud_org:density-functional-theory | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[topic].invenio_subject:archive_materialscloud_org:marvel-dd3 | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[topic].invenio_subject:archive_materialscloud_org:nics | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[topic].invenio_subject:archive_materialscloud_org:on-surface-reactions | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| concepts[topic].invenio_subject:archive_materialscloud_org:polymers | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| description | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | /metadata/description |
| license | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| publication_date | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | |
| title | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 | /metadata/title |
| updated_date | source · archive materialscloud org | connector:archive_materialscloud_org@1.0.0 |