Zobrazeno 1 - 10
of 60
pro vyhledávání: '"V. V. Bannikov"'
Autor:
V. V. Bannikov, T. V. Savitskaya
Publikováno v:
Тонкие химические технологии, Vol 14, Iss 4, Pp 59-68 (2019)
The analysis of the urgency of developing a decision and support information-modeling system for safety in the chemical industry is carried out. The article also covers the main elements of this information-modeling system. Key normative documents ba
Externí odkaz:
https://doaj.org/article/cf7955ee161a42758d3ad2b57a359103
Autor:
V. V. Bannikov, I. R. Shein
Publikováno v:
Journal of Structural Chemistry. 60:1859-1867
Structural and electronic properties, Fermi surface topology, and chemical bonding features in layered 1111-oxyarsenides LaRhAsO and LaIrAsO are studied and compared using ab initio simulations. The nonmagnetic metal LaIrAsO is found to be weakly sen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e2c26818cce000f37e25319480d04eec
https://doi.org/10.1134/s0022476619120011
https://doi.org/10.1134/s0022476619120011
Autor:
E. V. Zabolotskaya, V. V. Bannikov, Olga I. Gyrdasova, Alexander P. Tyutyunnik, Vladimir N. Krasil’nikov, F. Sauerzopf, T.V. Dyachkova, V. V. Marchenkov, Yu. A. Perevozchikova, M. A. Melkozerova
Publikováno v:
Physics of the Solid State. 59:1506-1511
Single-phase polycrystalline samples of Zn0.95Fe0.05O having the wurtzite structure and different morphology of particles were obtained using precursor technologies. It was found by electron spin resonance that iron enters the ZnO crystal lattice in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::42fcfc360835853bd1dcb3f4e9500876
https://doi.org/10.1134/s1063783417080157
https://doi.org/10.1134/s1063783417080157
Publikováno v:
Journal of Structural Chemistry. 57:1539-1544
A comparative study of the band structure and magnetic properties of the hexagonal and cubic modifications of aluminum nitride doped with boron, carbon, and oxygen in the nitrogen sublattice has been performed using the ab initio FLAPW-GGA method. Pr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::95e3ecdeca122bb31ce376e29ef59013
https://doi.org/10.1134/s0022476616080072
https://doi.org/10.1134/s0022476616080072
Autor:
V. V. Bannikov
Publikováno v:
Materials Chemistry and Physics. 171:119-125
The structural, elastic, magnetic properties, as well as electronic structure and chemical bonding picture of new oxide 3d1-perovskite BaVO3, recently synthesized, were systematically investigated involving the first-principles FLAPW-GGA calculations
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::232718f2f17f52050782751c1a5c98e4
https://doi.org/10.1016/j.matchemphys.2015.12.007
https://doi.org/10.1016/j.matchemphys.2015.12.007
Publikováno v:
Journal of Structural Chemistry. 57:281-286
Using density functional theory the electronic structure, chemical bond parameters, phase formation energies, and intrinsic defects in metal and non-metal sublattices of chalcogenides MX2 (M = Nb, Mo, W; X = Se, Te) are determined. For compounds with
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6c0397b225b2780b6de4d4c0aa26619e
https://doi.org/10.1134/s0022476616020062
https://doi.org/10.1134/s0022476616020062
Autor:
V. V. Bannikov, I. R. Shein
Publikováno v:
Computational Condensed Matter. 22:e00441
Based on the results of ab initio band structure calculations it was found that in a series of ternary and quarternary compounds (some antiperovskites, 1111-oxyarsenides and non-centrosymmetric superconductors) containing the atoms of platinum-group
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0872d313b07a464671ab565b553f8e37
https://doi.org/10.1016/j.cocom.2019.e00441
https://doi.org/10.1016/j.cocom.2019.e00441
Publikováno v:
Journal of Structural Chemistry. 56:148-162
A brief review of theoretical and experimental studies devoted to the design of novel magnetic materials based on non-magnetic semiconductor phases with the ZrCuSiAs structure type (such as LaCuSO, LaCuSeO, LaZnAsO, YZnAsO, or SrAgSeF) by doping thei
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::bd215d9858eed095274ef6425bd81aad
https://doi.org/10.1134/s0022476615010217
https://doi.org/10.1134/s0022476615010217
Autor:
V. V. Bannikov, I. R. Shein
Publikováno v:
Journal of Structural Chemistry. 57:805-807
Features of the electronic structure of layered ZrCuSiAs-like LaZnAsO1–δ phases at δ = 0.11 and 0.44 are briefly discussed based on the results of ab initio calculations. It is shown that the effect of oxygen vacancies on the electronic structure
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::88845d592ace94b4a842b941175a0d66
https://doi.org/10.1134/s0022476616040259
https://doi.org/10.1134/s0022476616040259
Publikováno v:
Technical Physics Letters. 42:260-262
Experimental results obtained in AlN synthesis by the high-temperature gas-phase method and analysis of reaction products phase composition are briefly described. It is demonstrated for the first time that dispersed aluminum nitride can be synthesize
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9d42be18b7fce88c4291f40ae42c9eed
https://doi.org/10.1134/s106378501603010x
https://doi.org/10.1134/s106378501603010x