Data · dataset · 2026
Photovoltaic properties of novel quaternary chalcogenides based on high-throughput screening and first-principles calculations
Listed in ScienceDB
This dataset mainly consists of the Energy Above Convex Hull (Ehull), energy band data, and SLME data relative to the energy difference of the stability convex packet mentioned in the article.
Description
It mainly contains the following four folders. File 1 is the thermodynamic stability calculation data of the material (“data of Ehull, .csv”); file 2 is the PBE bandgap calculation data of the material (“data of PBEbandgap, .csv”); file 3 is the calculated data of HSE bandgap of the material (“data of HSEbandgap, .csv”); File 4 is the calculated data of Spectral Limit Maximum Efficiency ((“data of SLME, .csv”).
Links
Where it is published
- DOI doi.org/10.57760/sciencedb.25170 ↗
DOI / persistent id · from scidb cn
Catalogue records · 1
- OAI-PMH record scidb.cn/oai?verb=GetRecord&metadataPrefix=oai_dc&identifier=10.57760%2… ↗
metadata API · from scidb cn
Topics
- From keywords
- Earth & Environmental Science · Engineering · Humanities · Life Sciences · Social Science
- Inferred from text
- Density functional theory 65% · Electronics, sensors and digital hardware 72%
Provenance · 1 source records, 12 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| ScienceDB | 10.57760/sciencedb.25170 | 9 d ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| access_level | source · scidb cn | connector:scidb_cn@1.0.0 | |
| concepts[field].anzsrc:group:4009 | enrichment · scidb cn | taxonomy-embedding@1.0.0 | title+keywords+description (72%) |
| concepts[field].local:field:earth-environmental | mapping · scidb cn | connector:scidb_cn@1.0.0 | |
| concepts[field].local:field:engineering | mapping · scidb cn | connector:scidb_cn@1.0.0 | |
| concepts[field].local:field:humanities | mapping · scidb cn | connector:scidb_cn@1.0.0 | |
| concepts[field].local:field:life-sciences | mapping · scidb cn | connector:scidb_cn@1.0.0 | |
| concepts[field].local:field:social-science | mapping · scidb cn | connector:scidb_cn@1.0.0 | |
| concepts[method].local:method:dft | enrichment · scidb cn | keyword-concept-rules@1.0.0 | title+description (65%) |
| description | source · scidb cn | connector:scidb_cn@1.0.0 | /metadata/dc/description |
| license | source · scidb cn | connector:scidb_cn@1.0.0 | /metadata/dc/rights |
| publication_date | source · scidb cn | connector:scidb_cn@1.0.0 | |
| title | source · scidb cn | connector:scidb_cn@1.0.0 | /metadata/dc/title |