Thermodynamic properties of tungsten disulfide from first principles in quasi-harmonic approximation
OO Vasiliev - Powder Metallurgy and Metal Ceramics, 2021 - Springer
The standard values (T= 298.15 K) of thermodynamic properties of hexagonal tungsten
disulfide 2H-WS 2 were calculated from first principles using density functional theory and …
disulfide 2H-WS 2 were calculated from first principles using density functional theory and …
Thermodynamic properties of 2H-MoSe2 from first principles quasi-harmonic approximation
O Vasiliev - Physics and Chemistry of Solid State, 2020 - journals.pnu.edu.ua
In this paper, we report the results of first-principles calculation of 2H-MoSe 2
thermodynamic properties within the quasi-harmonic approximation. The focus of the article …
thermodynamic properties within the quasi-harmonic approximation. The focus of the article …
[PDF][PDF] PHYSICS AND CHEMISTRY OF SOLID STATE
VS Precarpathian - threshold - researchgate.net
The unique physico-chemical properties of inorganic structural analogues of graphene and
graphite‒transition metal dichalcogenides (TMD) 2H-MX2 (Me= Mo, W, Ti, Nb, Zr, Ta, Hf …
graphite‒transition metal dichalcogenides (TMD) 2H-MX2 (Me= Mo, W, Ti, Nb, Zr, Ta, Hf …