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Page 1
γ-BaB2O4: High-Pressure High-Temperature Polymorph of Barium Borate with Edge-Sharing BO4 Tetrahedra.
Inorg Chem. 2022 Jan 31;61(4):2340-2350. doi: 10.1021/acs.inorgchem.1c03760. Epub 2022 Jan 18.
Inorg Chem. 2022.
PMID: 35040639
Crystal structures and P-T phase diagrams of SrC O and BaC O .
Sagatova DN, Gavryushkin PN, Sagatov NE, Banaev MV.
Sagatova DN, et al.
J Comput Chem. 2023 Dec 15;44(32):2453-2460. doi: 10.1002/jcc.27210. Epub 2023 Aug 23.
J Comput Chem. 2023.
PMID: 37610074
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Phase relations, thermal conductivity and elastic properties of ZrO2 and HfO2 polymorphs at high pressures and temperatures.
Sagatova DN, Sagatov NE, Gavryushkin PN, Solodovnikov SF.
Sagatova DN, et al.
Phys Chem Chem Phys. 2023 Dec 13;25(48):33013-33022. doi: 10.1039/d3cp04690g.
Phys Chem Chem Phys. 2023.
PMID: 38032101
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High-pressure transformations of CaC2O5 - a full structural trend from double [CO3] triangles through the isolated group of [CO4] tetrahedra to framework and layered structures.
Sagatova DN, Gavryushkin PN, Sagatov NE, Banaev MV.
Sagatova DN, et al.
Phys Chem Chem Phys. 2022 Oct 5;24(38):23578-23586. doi: 10.1039/d2cp01748b.
Phys Chem Chem Phys. 2022.
PMID: 36129339
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Phase relations, and mechanical and electronic properties of nickel borides, carbides, and nitrides from ab initio calculations.
Sagatov NE, Abuova AU, Sagatova DN, Gavryushkin PN, Abuova FU, Litasov KD.
Sagatov NE, et al. Among authors: sagatova dn.
RSC Adv. 2021 Oct 15;11(53):33781-33787. doi: 10.1039/d1ra06160g. eCollection 2021 Oct 8.
RSC Adv. 2021.
PMID: 35497551
Free PMC article.
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