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Computational prediction of new magnetic materials.
Rahmanian Koshkaki S, Allahyari Z, Oganov AR, Solozhenko VL, Polovov IB, Belozerov AS, Katanin AA, Anisimov VI, Tikhonov EV, Qian GR, Maksimtsev KV, Mukhamadeev AS, Chukin AV, Korolev AV, Mushnikov NV, Li H. Rahmanian Koshkaki S, et al. Among authors: oganov ar. J Chem Phys. 2022 Sep 28;157(12):124704. doi: 10.1063/5.0113745. J Chem Phys. 2022. PMID: 36182427
Ionic high-pressure form of elemental boron.
Oganov AR, Chen J, Gatti C, Ma Y, Ma Y, Glass CW, Liu Z, Yu T, Kurakevych OO, Solozhenko VL. Oganov AR, et al. Nature. 2009 Feb 12;457(7231):863-7. doi: 10.1038/nature07736. Epub 2009 Jan 28. Nature. 2009. PMID: 19182772
Novel hydrogen hydrate structures under pressure.
Qian GR, Lyakhov AO, Zhu Q, Oganov AR, Dong X. Qian GR, et al. Among authors: oganov ar. Sci Rep. 2014 Jul 8;4:5606. doi: 10.1038/srep05606. Sci Rep. 2014. PMID: 25001502 Free PMC article.
The phase diagram and hardness of carbon nitrides.
Dong H, Oganov AR, Zhu Q, Qian GR. Dong H, et al. Among authors: oganov ar. Sci Rep. 2015 May 6;5:9870. doi: 10.1038/srep09870. Sci Rep. 2015. PMID: 25943072 Free PMC article.
Backbone NxH compounds at high pressures.
Goncharov AF, Holtgrewe N, Qian G, Hu C, Oganov AR, Somayazulu M, Stavrou E, Pickard CJ, Berlie A, Yen F, Mahmood M, Lobanov SS, Konôpková Z, Prakapenka VB. Goncharov AF, et al. Among authors: oganov ar. J Chem Phys. 2015 Jun 7;142(21):214308. doi: 10.1063/1.4922051. J Chem Phys. 2015. PMID: 26049497
A novel phase of beryllium fluoride at high pressure.
Rakitin MS, Oganov AR, Niu H, Esfahani MM, Zhou XF, Qian GR, Solozhenko VL. Rakitin MS, et al. Among authors: oganov ar. Phys Chem Chem Phys. 2015 Oct 21;17(39):26283-8. doi: 10.1039/c5cp04010h. Epub 2015 Sep 21. Phys Chem Chem Phys. 2015. PMID: 26388165
Antiferromagnetic Stabilization in the Ti8O12 Cluster.
Yu X, Oganov AR, Popov IA, Qian G, Boldyrev AI. Yu X, et al. Among authors: oganov ar. Angew Chem Int Ed Engl. 2016 Jan 26;55(5):1699-703. doi: 10.1002/anie.201508439. Epub 2015 Dec 15. Angew Chem Int Ed Engl. 2016. PMID: 26668109
161 results