Abstract:
Using an evolutionary algorithm for predicting crystal structures, we found the possible ordered phases of a nonstoichiometric niobium carbide NbC0.83, a compound with 1/6 vacant sites in the carbon sublattice.
Citation:
M. G. Kostenko, A. V. Lukoyanov, A. A. Valeeva, “Vacancy ordered structures in a nonstoichiometric niobium carbide NbC0.83”, Mendeleev Commun., 29:6 (2019), 707–709
Linking options:
https://www.mathnet.ru/eng/mendc1640
https://www.mathnet.ru/eng/mendc/v29/i6/p707
This publication is cited in the following 8 articles:
A. A. Valeeva, A. V. Varaksin, S. V. Rempel, A. A. Rempel, “Atomistic structure and morphology of nanocrystalline niobium carbide obtained by electrochemical transport reactions”, Metallurgist, 2025
Santigopal Samanta, Shashidhar Gangavarapu, Bhagyaraj Jayabalan, Surendra Kumar Makineni, Monojit Dutta, Shiv Brat Singh, “Atomic-scale investigation of H-trapping by fine NbC precipitates in a low C ferritic steel”, Scripta Materialia, 234 (2023), 115537
M.I. Chebanenko, V.I. Popkov, H. Schröettner, A.A. Sushnikova, A.A. Rempel, A.A. Valeeva, “Sorption-photocatalytic performance of NbOx nanocrystals synthesized via heat-stimulated oxidation of niobium carbide”, Applied Surface Science, 582 (2022), 152422
A.V. Skripov, A.V. Soloninin, A.A. Valeeva, A.I. Gusev, A.A. Rempel, H. Wu, T.J. Udovic, “Hydrogen in nonstoichiometric cubic titanium monoxides: X-ray and neutron diffraction, neutron vibrational spectroscopy and NMR studies”, Journal of Alloys and Compounds, 887 (2021), 161353
M.I. Chebanenko, D.P. Danilovich, A.A. Lobinsky, V.I. Popkov, A.A. Rempel, A.A. Valeeva, “Novel high stable electrocatalyst based on non-stoichiometric nanocrystalline niobium carbide toward effective hydrogen evolution”, International Journal of Hydrogen Energy, 46:32 (2021), 16907
Albina A. Valeeva, Aleksandr I. Gusev, “Effect of nonstoichiometry on elastic properties of niobium carbide NbC”, International Journal of Refractory Metals and Hard Materials, 95 (2021), 105435
Tianchen Qin, Zegao Wang, Yuqing Wang, Flemming Besenbacher, Michal Otyepka, Mingdong Dong, “Recent Progress in Emerging Two-Dimensional Transition Metal Carbides”, Nano-Micro Lett., 13:1 (2021)
A. A. Valeeva, A. A. Rempel, S. V. Rempel', S. I. Sadovnikov, A. I. Gusev, “Nonstoichiometry, structure and properties of nanocrystalline oxides, carbides and sulfides”, Russian Chem. Reviews, 90:5 (2021), 601–626
Contact us: