The DOI matches its Crossref record; 2 of the 2 references it cites were found in a registry or an index.
Accurate defect levels obtained from the HSE06 range-separated hybrid functional
Open accessAbstract
Defect levels are a problem for standard implementations of density-functional theory and the error also influences the energetics. We demonstrate that the HSE06 functional, which describes the electronic structure of all group-IV semiconductors well (including Ge), gives highly accurate charge transition levels, too, if the defect wave function is host related---independent of localization. The degree of fulfilling the generalized Koopmans' theorem shows the reliability of the results and the highest-occupied eigenvalue always seems to give the correct vertical ionization energy.
Overview
The claims and statistics of this paper haven’t been checked yet.
Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.
Integrity signals
Registry
Cites
Statistics
Verification
Claims the paper makes
The claims and statistics of this paper haven’t been checked yet.
Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.
Self-check
Percentages, sums and reported differences re-computed from the paper’s own numbers.
The self-check needs the paper’s full text.
Citations
Cites
From ultrasoft pseudopotentials to the projector augmented-wave method
Kresse, G., & Joubert, D. (1999) · Physical Review B · doi:10.1103/physrevb.59.1758 · Cited by 85,307
Special points for Brillouin-zone integrations
Monkhorst, H. J., & Pack, J. D. (1976) · Physical Review B · doi:10.1103/physrevb.13.5188 · Cited by 71,721
Cited by
A silicon carbide room-temperature single-photon source
Castelletto, S., Johnson, B. C., Ivády, V., Stavrias, N., Umeda, T., Gali, A., & Ohshima, T. (2014) · Nature Materials · doi:10.1038/nmat3806 · Cited by 592
Self-citationElastic, Electronic, and Optical Properties of Two-Dimensional Graphyne Sheet
Kang, J., Li, J., Wu, F., Li, S.-S., & Xia, J.-B. (2011) · The Journal of Physical Chemistry C · doi:10.1021/jp206751m · Cited by 466
Computationally predicted energies and properties of defects in GaN
Lyons, J. L., & Van de Walle, C. G. (2017) · npj Computational Materials · doi:10.1038/s41524-017-0014-2 · Cited by 312
Optical Properties of Vanadium in 4 H Silicon Carbide for Quantum Technology
Spindlberger, L., Csóré, A., Thiering, G., Putz, S., Karhu, R., Hassan, J. U., Son, N. T., Fromherz, T., Gali, A., & Trupke, M. (2019) · Physical Review Applied · doi:10.1103/physrevapplied.12.014015 · Cited by 82
Metadata
- Authors
- Deák, P., Aradi, B., Frauenheim, T., Janzén, E., & Gali, A.
- Venue
- Physical Review B
- Publisher
- American Physical Society (APS)
- Published
- 2010-04-12
- Volume
- 81
- Issue
- 15
- ISSN
- 1098-0121 (ISSN-L)
- 1550-235X
- OpenAlex
- W1999242781
- Cited by
- 409
- References
- 2
- FWCI
- 9.48
- Type
- journal article
- Language
- en
- Open access
- bronze
About these checks
Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.
Statistics and arithmetic are recomputed, not judged.
Confidence bands are shown only for fields calibrated on our annotated test set. None is calibrated yet, so no band is shown.
What counts as a claim ›How we measure confidence ›How we check this ›
Are you an author, or do you see a problem with this page? Request a review
How to cite
Cite CoChat for the checks on this page, and the paper for its own findings.
- This page
- CoChat. (2026). Citation check: Accurate defect levels obtained from the HSE06 range-separated hybrid functional. https://app.cochat.ai/papers/10.1103/physrevb.81.153203
- The paper
- Deák, P., Aradi, B., Frauenheim, T., Janzén, E., & Gali, A. (2010). Accurate defect levels obtained from the HSE06 range-separated hybrid functional. Physical Review B. https://doi.org/10.1103/physrevb.81.153203
Data sources
Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.
