Andrei V. Bandura

11 papers Journal 11

Year	Rank	Type	Title / Venue / Authors
2020	J	`jnl`	First-Principles Calculations of Phonons and Thermodynamic Properties of Zr(Hf)S2-Based Nanotubes. J. Comput. Chem. Anton V. Domnin, Andrei V. Bandura, Robert A. Evarestov
2018	J	`jnl`	Infrared and Raman active vibrational modes in MoS2-based nanotubes: Symmetry analysis and first-principles calculations. J. Comput. Chem. Robert A. Evarestov, Andrei V. Bandura
2017	J	`jnl`	First-principles modeling of hafnia-based nanotubes. J. Comput. Chem. Robert A. Evarestov, Andrei V. Bandura, Vitaly V. Porsev, Alexey V. Kovalenko
2017	J	`jnl`	Phonon spectra, electronic, and thermodynamic properties of WS J. Comput. Chem. Robert A. Evarestov, Andrei V. Bandura, Vitaly V. Porsev, Alexey V. Kovalenko
2016	J	`jnl`	Application of zone-folding approach to the first-principles estimation of thermodynamic properties of carbon and ZrS J. Comput. Chem. Andrei V. Bandura, Vitaly V. Porsev, Robert A. Evarestov
2016	J	`jnl`	Temperature dependence of strain energy and thermodynamic properties of V J. Comput. Chem. Vitaly V. Porsev, Andrei V. Bandura, Robert A. Evarestov
2014	J	`jnl`	TiS J. Comput. Chem. Andrei V. Bandura, Robert A. Evarestov
2013	J	`jnl`	BaTiO J. Comput. Chem. Robert A. Evarestov, Andrei V. Bandura, Dmitrii D. Kuruch
2012	J	`jnl`	First-principles calculations on the four phases of BaTiO J. Comput. Chem. Robert A. Evarestov, Andrei V. Bandura
2012	J	`jnl`	First-principles calculations on thermodynamic properties of BaTiO3 rhombohedral phase. J. Comput. Chem. Andrei V. Bandura, Robert A. Evarestov
2008	J	`jnl`	A first-principles DFT study of UN bulk and (001) surface: Comparative LCAO and PW calculations. J. Comput. Chem. Robert A. Evarestov, Andrei V. Bandura, M. V. Losev, E. A. Kotomin, Yu. F. Zhukovskii, Dmitry Bocharov