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Novel superhard B-C-O phases predicted from first principles.
Wang S, Oganov AR, Qian G, Zhu Q, Dong H, Dong X, Davari Esfahani MM. Wang S, et al. Among authors: qian g. Phys Chem Chem Phys. 2016 Jan 21;18(3):1859-63. doi: 10.1039/c5cp05367f. Epub 2015 Dec 21. Phys Chem Chem Phys. 2016. PMID: 26686242
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. 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
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: qian g. J Chem Phys. 2015 Jun 7;142(21):214308. doi: 10.1063/1.4922051. J Chem Phys. 2015. PMID: 26049497
The stability and unexpected chemistry of oxide clusters.
Yu X , Oganov AR , Zhu Q , Qi F , Qian G . Yu X , et al. Among authors: qian g. Phys Chem Chem Phys. 2018 Dec 12;20(48):30437-30444. doi: 10.1039/c8cp03519a. Phys Chem Chem Phys. 2018. PMID: 30500006
Novel hydrogen hydrate structures under pressure.
Qian GR, Lyakhov AO, Zhu Q, Oganov AR, Dong X. Qian GR, et al. Sci Rep. 2014 Jul 8;4:5606. doi: 10.1038/srep05606. Sci Rep. 2014. PMID: 25001502 Free PMC article.
A stable compound of helium and sodium at high pressure.
Dong X, Oganov AR, Goncharov AF, Stavrou E, Lobanov S, Saleh G, Qian GR, Zhu Q, Gatti C, Deringer VL, Dronskowski R, Zhou XF, Prakapenka VB, Konôpková Z, Popov IA, Boldyrev AI, Wang HT. Dong X, et al. Among authors: qian gr. Nat Chem. 2017 May;9(5):440-445. doi: 10.1038/nchem.2716. Epub 2017 Feb 6. Nat Chem. 2017. PMID: 28430195
1,901 results