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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: davari esfahani mm. 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
Novel magnesium borides and their superconductivity.
Davari Esfahani MM, Zhu Q, Dong H, Oganov AR, Wang S, Rakitin MS, Zhou XF. Davari Esfahani MM, et al. Phys Chem Chem Phys. 2017 Jun 7;19(22):14486-14494. doi: 10.1039/c7cp00840f. Phys Chem Chem Phys. 2017. PMID: 28534591
Prediction and Synthesis of Dysprosium Hydride Phases at High Pressure.
Salke NP, Davari Esfahani MM, Yedukondalu N, Zhang Y, Kruglov IA, Zhou J, Greenberg E, Prakapenka VB, Liu J, Oganov AR, Lin JF. Salke NP, et al. Among authors: davari esfahani mm. Inorg Chem. 2020 Apr 20;59(8):5303-5312. doi: 10.1021/acs.inorgchem.9b03078. Epub 2020 Mar 30. Inorg Chem. 2020. PMID: 32223161
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: esfahani mm. 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