The DOI matches its Crossref record; 2 of the 2 references it cites were found in a registry or an index.
Competing Structural Instabilities in Cubic Perovskites
Abstract
We study the antiferrodistortive instability and its interaction with ferroelectricity in cubic perovskite compounds. Our first-principles calculations show that coexistence of both instabilities is very common. We develop a first-principles scheme to study the thermodynamics of these compounds when both instabilities are present, and apply it to SrTi${\mathrm{O}}_{3}$. We find that increased pressure enhances the antiferrodistortive instability while suppressing the ferroelectric one. Moreover, the presence of one instability tends to suppress the other. A very rich $P$- $T$ phase diagram results.
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Shannon, R. D. (1976) · Acta Crystallographica Section A · doi:10.1107/s0567739476001551 · Cited by 66,145
Computer Simulation of Liquids
Allen, M. P., & Tildesley, D. J. (2017) · doi:10.1093/oso/9780198803195.001.0001 · Cited by 20,945
Cited by
Improper ferroelectricity in perovskite oxide artificial superlattices
Bousquet, E., Dawber, M., Stucki, N., Lichtensteiger, C., Hermet, P., Gariglio, S., Triscone, J.-M., & Ghosez, P. (2008) · Nature · doi:10.1038/nature06817 · Cited by 932
First-principles theory of ferroelectric phase transitions for perovskites: The case ofBaTiO3
Zhong, W., Vanderbilt, D., & Rabe, K. M. (1995) · Physical Review B · doi:10.1103/physrevb.52.6301 · Cited by 785
Self-citationZhang, Y., Sun, J., Perdew, J. P., & Wu, X. (2017) · Physical Review B · doi:10.1103/physrevb.96.035143 · Cited by 258
Metadata
- Authors
- Zhong, W., & Vanderbilt, D.
- Venue
- Physical Review Letters
- Publisher
- American Physical Society (APS)
- Published
- 1995-03-27
- Volume
- 74
- Issue
- 13
- Pages
- 2587-2590
- ISSN
- 0031-9007 (ISSN-L)
- 1079-7114
- OpenAlex
- W2035452016
- Cited by
- 371
- References
- 2
- FWCI
- 10.59
- Type
- journal article
- Language
- en
- Open access
- closed
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- Zhong, W., & Vanderbilt, D. (1995). Competing Structural Instabilities in Cubic Perovskites. Physical Review Letters. https://doi.org/10.1103/physrevlett.74.2587
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