Browsing by Subject AB INITIO CALCULATION
Showing results 1 to 6 of 6
| Issue Date | Title | Author(s) |
| 2023 | Ab Initio Study of the Electronic Properties of a Silicene Anode Subjected to Transmutation Doping | Galashev, A. Y.; Vorob’ev, A. S. |
| 2022 | Effect of Li and Li-RE Co-Doping on Structure, Stability, Optical and Electrical Properties of Bismuth Magnesium Niobate Pyrochlore | Koroleva, M. S.; Krasnov, A. G.; Senyshyn, A.; Schökel, A.; Shein, I. R.; Vlasov, M. I.; Piir, I. V. |
| 2018 | Magnetization, resistivity, specific heat and ab initio calculations of Gd5Sb3 | Samatham, S. S.; Patel, A. K.; Lukoyanov, A. V.; Suresh, K. G. |
| 2018 | Old puzzle of incommensurate crystal structure of calaverite AuTe2 and predicted stability of novel AuTe compound | Streltsov, S. V.; Roizen, V. V.; Ushakov, A. V.; Oganov, A. R.; Khomskii, D. I. |
| 2020 | Structural disorder and short-range order in full Heusler alloys Fe2VAl and Co2CrAl from first principles calculations | Kostenko, G.; Lukoyanov, V. |
| 2023 | Thermal Disorder in Finite-Length Carbon Nanowire | Wong, C. H.; Buntov, E. A.; Yip, W. S.; To, S.; Guseva, M. B.; Zatsepin, A. F. |
