In particular, FePS3 is a Mott insulator with a band gap of ∼ 1.5 eV. In this study, we used Raman spectroscopy and first-principles...
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We present a formulation of Raman spectroscopy in molecular junctions, based on a many-body state representation of the molecule. The approach goes beyond ...
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The geometric, electronic, and vibrational properties of monolayer 1T-molybdenum disulfide (MoS2) have been studied by using the first-principles calculations.
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Feb 27, 2014 · These new Raman-active modes involve the vibrations of the chalcogen and the transition metal atoms, belonging to the A′1 or A1g irreducible ...
Calculated vibrational patterns in the T d phase (a-e) and corresponding B u and A u modes in the 1T phases (f-j). A, D, Q, S modes vibrate in the bc plane and ...
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phonon ≡ quantum of crystal vibrational energy phonons: quasi-particles (elementary excitations in solids). - En = (n+1/2)ħω,.
This chapter is a review of the application of Raman spectroscopy in characterizing the properties of graphene, both exfoliated and synthesized,.
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