The DOI matches its Crossref record; 1 of the 1 references it cites were found in a registry or an index.
A mixed-space approach to first-principles calculations of phonon frequencies for polar materials
Open accessAbstract
We propose a mixed-space approach using the accurate force constants calculated by the direct approach in real space and the dipole-dipole interactions calculated by linear response theory in reciprocal space, making the accurate prediction of phonon frequencies for polar materials possible using the direct approach as well as linear response theory. As examples, by using the present approach, we predict the first-principles phonon properties of the polar materials α-Al(2)O(3), MgO, c-SiC, and h-BN, which are in excellent agreement with available experimental data.
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
Self-interaction correction to density-functional approximations for many-electron systems
Perdew, J. P., & Zunger, A. (1981) · Physical Review B · doi:10.1103/physrevb.23.5048 · Cited by 20,887
Cited by
ShengBTE: A solver of the Boltzmann transport equation for phonons
Li, W., Carrete, J., A. Katcho, N., & Mingo, N. (2014) · Computer Physics Communications · doi:10.1016/j.cpc.2014.02.015 · Cited by 3,147
AFLOW: An automatic framework for high-throughput materials discovery
Curtarolo, S., Setyawan, W., Hart, G. L. W., Jahnatek, M., Chepulskii, R. V., Taylor, R. H., Wang, S., Xue, J., Yang, K., Levy, O., et al. (2012) · Computational Materials Science · doi:10.1016/j.commatsci.2012.02.005 · Cited by 1,531
Distributions of phonon lifetimes in Brillouin zones
Togo, A., Chaput, L., & Tanaka, I. (2015) · Physical Review B · doi:10.1103/physrevb.91.094306 · Cited by 1,517
Phonon-limited mobility inn-type single-layer MoS2from first principles
Kaasbjerg, K., Thygesen, K. S., & Jacobsen, K. W. (2012) · Physical Review B · doi:10.1103/physrevb.85.115317 · Cited by 1,295
Tadano, T., & Tsuneyuki, S. (2015) · Physical Review B · doi:10.1103/physrevb.92.054301 · Cited by 640
Metadata
- Authors
- Wang, Y., Wang, J. J., Wang, W. Y., Mei, Z. G., Shang, S. L., Chen, L. Q., & Liu, Z. K.
- Venue
- Journal of Physics: Condensed Matter
- Publisher
- IOP Publishing
- Published
- 2010-04-30
- Volume
- 22
- Issue
- 20
- Pages
- 202201
- ISSN
- 0953-8984 (ISSN-L)
- 1361-648X
- OpenAlex
- W2023853942
- Cited by
- 252
- References
- 1
- FWCI
- 5.69
- 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: A mixed-space approach to first-principles calculations of phonon frequencies for polar materials. https://app.cochat.ai/papers/10.1088/0953-8984/22/20/202201
- The paper
- Wang, Y., Wang, J. J., Wang, W. Y., Mei, Z. G., Shang, S. L., Chen, L. Q., & Liu, Z. K. (2010). A mixed-space approach to first-principles calculations of phonon frequencies for polar materials. Journal of Physics: Condensed Matter. https://doi.org/10.1088/0953-8984/22/20/202201
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.
