3R and 2H polytypes of MoS 2 : DFT and DFPT calculations of structural, optoelectronic, vibrational and thermodynamic properties

Title
3R and 2H polytypes of MoS 2 : DFT and DFPT calculations of structural, optoelectronic, vibrational and thermodynamic properties
Authors
Keywords
MoS, 2, DFT calculations, Optoelectronic properties, Vibrational properties, Thermodynamic properties
Journal
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS
Volume 111, Issue -, Pages 25-33
Publisher
Elsevier BV
Online
2017-07-16
DOI
10.1016/j.jpcs.2017.07.010

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