Minakov, D.V., Levashov, P.R., Fokin, V.B. (2017) Vibrational spectrum and entropy in simulation of melting. Computational Materials Science, 127. 42-47 doi:10.1016/j.commatsci.2016.10.023

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Reference Type	Journal (article/letter/editorial)
Title	Vibrational spectrum and entropy in simulation of melting
Journal	Computational Materials Science
Authors	Minakov, D.V.		Author
	Levashov, P.R.		Author
	Fokin, V.B.		Author
Year	2017 (February)	Volume	127
Publisher	Elsevier BV
DOI	doi:10.1016/j.commatsci.2016.10.023Search in ResearchGate
	Generate Citation Formats
Mindat Ref. ID	9510087	Long-form Identifier	mindat:1:5:9510087:8
GUID	0
Full Reference	Minakov, D.V., Levashov, P.R., Fokin, V.B. (2017) Vibrational spectrum and entropy in simulation of melting. Computational Materials Science, 127. 42-47 doi:10.1016/j.commatsci.2016.10.023
Plain Text	Minakov, D.V., Levashov, P.R., Fokin, V.B. (2017) Vibrational spectrum and entropy in simulation of melting. Computational Materials Science, 127. 42-47 doi:10.1016/j.commatsci.2016.10.023
In	(n.d.) Computational Materials Science Vol. 127. Elsevier BV

	Minakov, D.V., Levashov, P.R. (2016) Thermodynamic properties of LiD under compression with different pseudopotentials for lithium. Computational Materials Science, 114. 128-134 doi:10.1016/j.commatsci.2015.12.008
	Galtsov, I.S.; Fokin, V.B.; Minakov, D.V.; Levashov, P.R. (2025) SKiES: The program for ab initio calculations of transport properties based on Allen's method for solving Boltzmann equation. Computer Physics Communications, 317. doi:10.1016/j.cpc.2025.109834
	Knyazev, D.V., Levashov, P.R. (2013) Ab initio calculation of transport and optical properties of aluminum: Influence of simulation parameters. Computational Materials Science, 79. 817-829 doi:10.1016/j.commatsci.2013.04.066
	*Ntallis, N., Efthimiadis, K.G. (2015) Micromagnetic simulation of an antiferromagnetic particle. Computational Materials Science, 97. 42-47 doi:10.1016/j.commatsci.2014.10.010*
	*Nastovjak, A.G., Shterental, D.V., Shwartz, N.L. (2023) Simulation of GaAs nanowire annealing. Computational Materials Science, 228. 112310 doi:10.1016/j.commatsci.2023.112310*
	*Mishnaevsky, Leon, Levashov, Evgeny (2013) Editorial. Computational Materials Science, 76. 1-2 doi:10.1016/j.commatsci.2012.12.001*
	*Vanpoucke, Danny E.P. (2020) Partitioning the vibrational spectrum: Fingerprinting defects in solids. Computational Materials Science, 181. 109736pp. doi:10.1016/j.commatsci.2020.109736*
	Tran, Anh V., Wang, Yan (2017) Reliable Molecular Dynamics: Uncertainty quantification using interval analysis in molecular dynamics simulation. Computational Materials Science, 127. 141-160 doi:10.1016/j.commatsci.2016.10.021
	Torres, V.J.B., Coutinho, J., Briddon, P.R. (2005) Local vibrational modes of Zn–H–As defects in GaAs, ZnSe and ZnTe. Computational Materials Science, 33 (1). 145-147 doi:10.1016/j.commatsci.2004.12.055
	Paramonov, M. A., Minakov, D. V., Fokin, V. B., Knyazev, D. V., Demyanov, G. S., Levashov, P. R. (2022) Ab initio inspection of thermophysical experiments for zirconium near melting. Journal of Applied Physics, 132 (6) 65102 doi:10.1063/5.0088504
	*Mireja, Shubham, Khakhar, Devang V. (2025) Molecular simulation of the melting of PVDF crystal phases. Computational Materials Science, 250. doi:10.1016/j.commatsci.2025.113690*

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Minakov, D.V., Levashov, P.R., Fokin, V.B. (2017) Vibrational spectrum and entropy in simulation of melting. Computational Materials Science, 127. 42-47 doi:10.1016/j.commatsci.2016.10.023

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